NC(=O)C1=CC=CC=C1O 2-hydroxybenzamide OC(=O)C1=CC=CC=C1O 2-hydroxybenzoic-acid C1=C(C=C2C=CC=CN12)C1=CC=CC=C1 2-phenylindolizine NNC1=CC=C(C=C1)C(O)=O 4-hydrazinobenzoic-acid OC(=O)C1=CC=C(C=C1)N1N=C(N=C1C1=CC=CC=C1O)C1=CC=CC=C1O Deferasirox-api OC1=CC=CC=C1C1=NC(=O)C2=CC=CC=C2O1 Deferasirox-benzoxazin OC1=CC=CC=C1C(=O)NC(=O)C1=CC=CC=C1O Deferasirox-diacyl NNC1=CC=C(C=C1)C(O)=O Deferasirox-hydrazino C[C@@H](O)[C@@H]1NC(=O)[C@@H](N)C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C1=O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(O)(=O)=O)=C1)[C@H](O)CC(N)=O FR-179642 CCCCCCCCCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O FR-901379 NC1=CC=C(Cl)C=N1.COC1=CC=C(N)N=C1.CC(=O)C1CCOC1=O.COC1CCC2=NC(C)=C(CCCl)C(=O)N2C1.COC1=CN2C(=O)C(CCCl)=C(C)N=C2C=C1.CC1=C(CCC2CCC(CC2)C2=NOC3=C2C=C(F)C=C3)C(=O)N2CC(O)CCC2=N1.COC1CCC2=NC(C)=C(CCC3CCC(CC3)C3=NOC4=C3C=C(F)C=C4)C(=O)N2C1 Risperidone-7-OH-ros NC1=CC=C(Cl)C=N1.COC1=CC=C(N)N=C1.CC(=O)C1CCOC1=O.COC1CCC2=NC(C)=C(CCCl)C(=O)N2C1.COC1=CN2C(=O)C(CCCl)=C(C)N=C2C=C1.CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CC(O)CCC2=N1.COC1CCC2=NC(C)=C(CCN3CCC(CC3)C3=NOC4=C3C=CC(F)=C4)C(=O)N2C1 Risperidone-7-OH-syn-scheme CC(=O)C1CCOC1=O.NC1=C(OCC2=CC=CC=C2)C=CC=N1.CC1=C(CCCl)C(=O)N2CCCC(O)C2=N1.CC1=C(CCCl)C(=O)N2C=CC=C(OCC3=CC=CC=C3)C2=N1.CC1=C(CCC2CCC(CC2)C2=NOC3=C2C=C(F)C=C3)C(=O)N2CCCC(O)C2=N1 Risperidone-9-OH-ros CC(=O)C1CCOC1=O.NC1=C(OCC2=CC=CC=C2)C=CC=N1.CC1=C(CCCl)C(=O)N2CCCC(O)C2=N1.CC1=C(CCCl)C(=O)N2C=CC=C(OCC3=CC=CC=C3)C2=N1.CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCC(O)C2=N1 Risperidone-9-oh-syn-scheme CC(C)C1=CC2=CCC3[C@](C)(CCC[C@@]3(C)C(O)=O)C2CC1 abietic-acid NC(=O)C1=C(N)N(C=N1)[C@@H]1O[C@H](CO)C(O)C1O acadesine-str CC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1NC1C=C(CO)C(O)C(O)C1O acarbose-str CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.NC1=C(Br)C=C(Br)C=C1CN[C@H]1CC[C@H](O)CC1 acebrophylline-str I.II.OC(=O)CCl.CN1C2=C(NC=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.NC1=C(Br)C=C(Br)C=C1CN[C@H]1CC[C@H](O)CC1 acebrophylline-syn-scheme CCCC(=O)NC1=CC(C(C)=O)=C(OCC2CO2)C=C1 acebutolol-ep-imp-a Cl.CC(C)NCC(O)COC1=C(C=C(NC(C)=O)C=C1)C(C)=O acebutolol-ep-imp-b CCCC(=O)NC1=CC(C(C)=O)=C(O)C=C1 acebutolol-ep-imp-c Cl.CC(C)NCC(O)COC1=C(C=C(N)C=C1)C(C)=O acebutolol-ep-imp-d Cl.CCCC(=O)NC1=CC(C(C)=O)=C(OCC(O)CNC(C)C)C=C1 acebutolol-hcl OC(=O)COC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-api OC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-a COC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-b CCOC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-c COC(=O)COC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-d CCOC(=O)COC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-e ClC1=CC=CC(Cl)=C1NC1=C(CC(=O)OCC(=O)OCC2=CC=CC=C2)C=CC=C1 aceclofenac-ep-imp-f OC(=O)COC(=O)COC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-g OC(=O)COC(=O)COC(=O)COC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 aceclofenac-ep-imp-h ClC1=CC=CC(Cl)=C1N1C(=O)CC2=C1C=CC=C2 aceclofenac-ep-imp-i C1CNCCN1.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O acephylline-piperazine CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O acephylline-str [CH]1CNCCN1.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O acepifylline-str CC(=O)N[C@@H](CS)C(O)=O acetylcysteine-api N[C@@H](CSSC[C@H](N)C(O)=O)C(O)=O acetylcysteine-ep-imp-a N[C@@H](CS)C(O)=O acetylcysteine-ep-imp-b CC(=O)N[C@@H](CSSC[C@H](NC(C)=O)C(O)=O)C(O)=O acetylcysteine-ep-imp-c CC(=O)N[C@@H](CSC(C)=O)C(O)=O acetylcysteine-ep-imp-d CC1=C(C=CC=C1)N1C(CF)=NC2=CC=C(C=C2C1=O)[N](O)=O afloqualone-02-str CC1=C(C=CC=C1)N1C(CF)=NC2=CC=C(N)C=C2C1=O afloqualone-str CCCSC1=CC2=C(NC(NC(=O)OC)=N2)C=C1 albendazole CCCSC1=CC2=C(NC(NC(=O)OC)=N2)C=C1 albendazole-api CCCSC1=CC2=C(NC(N)=N2)C=C1 albendazole-ep-imp-a CCCS(=O)C1=CC2=C(NC(NC(=O)OC)=N2)C=C1 albendazole-ep-imp-b CCCS(=O)(=O)C1=CC2=C(NC(NC(=O)OC)=N2)C=C1 albendazole-ep-imp-c CCCS(=O)(=O)C1=CC2=C(NC(N)=N2)C=C1 albendazole-ep-imp-d COC(=O)NC1=NC2=C(N1)C=CC=C2 albendazole-ep-imp-e COC(=O)NC1=NC2=C(N1)C=CC(SC)=C2 albendazole-ep-imp-f COC1=C(OC)C=C2C(N)=NC(=NC2=C1)N(C)CCCNC(=O)C1=CC=CO1 alfuzosin-ep-imp-a COC1=C(OC)C=C2C(N)=NC(Cl)=NC2=C1 alfuzosin-ep-imp-b COC1=C(OC)C=C2C(N)=NC(NCCCN(C)C(=O)C3CCCO3)=NC2=C1 alfuzosin-ep-imp-c COC1=C(OC)C=C2C(N)=NC(=NC2=C1)N(C)CCCN alfuzosin-ep-imp-d [H]C(=O)NCCCN(C)C1=NC2=CC(OC)=C(OC)C=C2C(N)=N1 alfuzosin-ep-imp-e Cl.COC1=C(OC)C=C2C(N)=NC(=NC2=C1)N(C)CCCNC(=O)C1CCCO1 alfuzosin-hcl Cl.[2H]C([2H])([2H])N(CCCNC(=O)C1CCCO1)C1=NC2=CC(OC)=C(OC)C=C2C(N)=N1 alfuzosin-hcl-d3 O=C1NC=NC2=C1C=NN2 allopurinol-api NC(=O)C1=C(N)NN=C1 allopurinol-ep-imp-A NC(=O)C1=C(NC=O)NN=C1 allopurinol-ep-imp-b NC(=O)C1=C(NN=C1)N1C=NN=C1 allopurinol-ep-imp-c CCOC(=O)C1=C(N)NN=C1 allopurinol-ep-imp-d CCOC(=O)C1=C(NC=O)NN=C1 allopurinol-ep-imp-e OCC1=CC2=C(C(O)=C1)C(=O)C1=C(C=CC=C1O)C2=O aloe-emodin NC1=C(Br)C=C(Br)C=C1C(O)=O ambroxol-acid NC1=C(Br)C=C(Br)C=C1CNC1CC[C@H](O)CC1 ambroxol-base NC1=C(Br)C=C(Br)C=C1CN[C@@H]1CC[C@H](O)CC1 ambroxol-cis NC1=C(Br)C=C(Br)C=C1CO ambroxol-ep-imp-a O[C@H]1CC[C@@H](CC1)N1CNC2=C(Br)C=C(Br)C=C2C1 ambroxol-ep-imp-b O[C@H]1CC[C@@H](CC1)\N=C\C1=CC(Br)=CC(Br)=C1N ambroxol-ep-imp-c NC1=C(Br)C=C(Br)C=C1CNC1CC[C@H](O)CC1 ambroxol-ep-imp-d NC1=C(Br)C=C(Br)C=C1C=O ambroxol-ep-imp-e Cl.NC1=C(Br)C=C(Br)C=C1CN[C@H]1CC[C@H](O)CC1 ambroxol-hcl NC1=C(Br)C=C(Br)C=C1CN[C@H]1CC[C@H](O)CC1 ambroxol-str CCCCC1=C(C(=O)C2=CC(I)=C(OCCN(CC)CC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-base CCCCC1=C(C(=O)C2=CC(I)=C(OCCN)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-di-desethyl CCCCC1=C(C(=O)C2=CC=C(OCCN(CC)CC)C=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-a Cl.CCCCC1=C(C(=O)C2=CC(I)=C(OCCNCC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-b CCCCC1=C(C(=O)C2=CC(I)=C(OCCNCC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-b-hcl CCCCC1=C(C(=O)C2=CC=C(OCCN(CC)CC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-c CCCCC1=C(C(=O)C2=CC(I)=C(O)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-d CCCCC1=C(C(=O)C2=CC=C(O)C=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-e CCCCC1=C(C(=O)C2=CC=C(O)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-f CCCC(OC)C1=C(C(=O)C2=CC(I)=C(OCCN(CC)CC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-ep-imp-g Cl.CCN(CC)CCCl amiodarone-ep-imp-h Cl.CCCCC1=C(C(=O)C2=CC(I)=C(OCCN(CC)CC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-hcl CCCCC1=C(C(=O)C2=CC(I)=C(OCCN(=O)(CC)CC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-n-oxide CCCCC1=C(C(=O)C2=CC(I)=C(OCCN(CC)CC)C(I)=C2)C2=C(O1)C=CC=C2 amiodarone-str CCOC(=O)C1=C(COCCN=N=N)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-azido CCOC(=O)C1=C(COCCN)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-base OS(=O)(=O)C1=CC=CC=C1.CCOC(=O)C1=C(COCCN)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-besylate CCOC(=O)C1=C(COCCNC(=O)C2=CC=CC=C2C(=O)NC)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-ep-imp-b CCOC(=O)C1=C(COCCN)NC(COCCN)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-ep-imp-c CCOC(=O)C1=C(C2=CC=CC=C2Cl)C(C(=O)OC)=C(C)N=C1COCCN amlodipine-ep-imp-d CCOC(=O)C1=C(C)NC(COCCN)=C(C1C1=CC=CC=C1Cl)C(=O)OCC amlodipine-ep-imp-e COC(=O)C1=C(C)NC(COCCN)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-ep-imp-f CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-ep-imp-g CCOC(=O)C1=C(COCCNC(=O)C2=CC=CC=C2C(O)=O)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-ep-imp-h OC(=O)\C=C/C(O)=O.CCOC(=O)C1=C(COCCN)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-maleate CCOC(=O)C1=C(COCCN2C(=O)C3=C(C=CC=C3)C2=O)NC(C)=C(C1C1=CC=CC=C1Cl)C(=O)OC amlodipine-phthalimido OC(=O)\C=C\C(O)=O.CCOC(=O)C1=C(C2=CC=CC=C2Cl)C(C(=O)OC)=C(C)N=C1COCCN amlodipine-rc-a O.O.O.[H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@@]2([H])NC(=O)[C@H](N)C1=CC=C(O)C=C1)C(O)=O amoxicillin-3h20 [H][C@@]1(NC(=O)[C@H](N)C2=CC=C(O)C=C2)C(=O)N2[C@@H](C(=O)O[Na])C(C)(C)S[C@]12[H] amoxicillin-sodium C[C@]12CCC3C(CC=C4C[C@H](O)CC[C@]34C)C1CC=C2 androstadienol C[C@]12CCC3C(CCC4=C[C@H](O)CC[C@]34C)C1CC=C2 androstadienol-3-alpha C[C@]12CCC3C(CCC4=C[C@@H](O)CC[C@]34C)C1CC=C2 androstadienol-3-beta C[C@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C1CC=C2 androstadienol-epi C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC=C2 androstadienone C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC=C2 androstadienone-3-one [H][C@@]12CCC3C4CC(=O)C(=O)[C@@]4(C)CCC3[C@@]1(C)CCC(=O)C2 androstatrione [H][C@@]12CCC3C4CC=C[C@@]4(C)CCC3[C@@]1(C)CC[C@@H](O)C2 androstenol-3-alpha [H][C@@]12CCC3C4CC=C[C@@]4(C)CCC3[C@@]1(C)CC[C@H](O)C2 androstenol-3-beta [H][C@@]12CCC3C4CC=C[C@@]4(C)CCC3[C@@]1(C)CC[C@H](O)C2 androstenol-epi [H][C@@]12CCC3C4CC=C[C@@]4(C)CCC3[C@@]1(C)CCC(=O)C2 androstenone [H][C@@]12CCC3C4CC=C[C@@]4(C)CCC3[C@@]1(C)CCC(C2)(OC)OC androstenone-methyl-ketal [H][C@@]12CCC3C4CCC(=O)[C@@]4(C)CCC3[C@@]1(C)CC[C@@H](O)C2 androsterone-3-alpha [H][C@@]12CCC3C4CCC(=O)[C@@]4(C)CCC3[C@@]1(C)CC[C@H](O)C2 androsterone-3-beta [H][C@@]12CCC3C4CCC(=O)[C@@]4(C)CCC3[C@@]1(C)CC[C@H](O)C2 androsterone-epi [H][C@@]12CCC3C4CCC(=O)[C@@]4(C)CCC3[C@@]1(C)C=C[C@H](O)C2 androsterone-epi-1,2-dehydro CCCCCOC1=CC=C(C=C1)C1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@H](O)C1=CC=C(O)C=C1)[C@@H](C)O anidulafungin-str [H][C@]12CC3=CC=C(O)C(O)=C3C3=CC=CC(CCN1C)=C23 apomorphine [H][C@]12CC3=C(C(=O)C(=O)C=C3)C3=CC=CC(CCN1C)=C23 apomorphine-di-ketone [H][C@]12CC3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3C3=CC=CC(CCN1C)=C23 apomorphine-di-tms [H][C@]12CC3=CC=C(OC)C(O)=C3C3=CC=CC(CCN1C)=C23 apomorphine-methyl ClC1=C(Cl)C(=CC=C1)N1CCN(CCCCOC2=CC3=C(CCC(=O)N3)C=C2)CC1 aripiprazole-api [2H]C([2H])(OC1=CC2=C(CCC(=O)N2)C=C1)C([2H])([2H])C([2H])([2H])C([2H])([2H])N1CCN(CC1)C1=CC=CC(Cl)=C1Cl aripiprazole-d8 CC[C@@H]1\C=C(C)\C[C@H](C)CC(OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)OC([C@H](C)\C=C\C1=O)C(\C)=C\[C@@H]1CC[C@@H](O)[C@@H](C1)OC ascomycin-anhydro CC[C@@H]1\C=C(C)\C[C@H](C)CC(OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)OC([C@H](C)[C@@H](O)CC1=O)C(\C)=C\[C@@H]1CC[C@@H](O)[C@@H](C1)OC ascomycin-api CC(C)NCC(O)COC1=CC=C(CC(N)=O)C=C1 atenolol-api NC(=O)CC1=CC=C(O)C=C1 atenolol-ep-imp-a NC(=O)CC1=CC=C(OCC(O)CO)C=C1 atenolol-ep-imp-b NC(=O)CC1=CC=C(OCC2CO2)C=C1 atenolol-ep-imp-c NC(=O)CC1=CC=C(OCC(O)CCl)C=C1 atenolol-ep-imp-d NC(=O)CC1=CC=C(OCC(O)COC2=CC=C(CC(N)=O)C=C2)C=C1 atenolol-ep-imp-e CC(C)N(CC(O)COC1=CC=C(CC(N)=O)C=C1)CC(O)COC1=CC=C(CC(N)=O)C=C1 atenolol-ep-imp-f CC(C)NCC(O)COC1=CC=C(CC(O)=O)C=C1 atenolol-ep-imp-g CC(C)NCC(O)COC1=CC=C(CC#N)C=C1 atenolol-ep-imp-h CC(C)C12OC(CC(O)CC(O)=O)CCN1C(O)(C1=CC=C(F)C=C1)C1(OC21C(=O)NC1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-2-OH-ether-FXA CC(C)C1=C(C(=O)NC2=C(O)C=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-2-oh CC(C)C1=C(C(=O)NC2=C(O)C=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-2-oh-na CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)CC(=O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-3-oxo-acid CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)CC(=O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-3-oxo-na CC(C)C1=C(C(=O)NC2=CC=C(O)C=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-4-oh CC(C)C1(O)N2CCC(CC(O)CC(O)=O)OC2(C2=CC=C(F)C=C2)C2(OC12C(=O)NC1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-5-OH-ether-FX1 CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CCC(=O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-5-oxo-acid CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CCC(=O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-5-oxo-na CC(C)C1(O)OC(O)(C2=CC=C(F)C=C2)C2(OC12C(=O)NC1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-FXA2 CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H]1C[C@H](CC(=O)OC(C)(C)C)OC(C)(C)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-L1 CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-acid CC(C)C1=C(C(=O)NC2=CC=C(O)C=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-acid-4-oh CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(C2=CC=CC=C2)=C(N1CC[C@@H](O)C\C=C\C(O)=O)C1=CC=C(F)C=C1 atorvastatin-dehydro-acid CCOC(=O)\C=C\C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(C2=CC=CC=C2)=C1C1=CC=C(F)C=C1 atorvastatin-dehydro-ethyl-ester [Na]OC(=O)\C=C\C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(C2=CC=CC=C2)=C1C1=CC=C(F)C=C1 atorvastatin-dehydro-sodium CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-desfluoro CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1C1OC1C1OC1C(=O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1C1OC1C(=O)CC(=O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1.CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1C(O)C(O)C(=O)CC(=O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-diketo-diol-epoxide CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-ep-imp-a-acid CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-ep-imp-a-calcium CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)O[Na])C1=CC=CC=C1)C1=CC=CC=C1 atorvastatin-ep-imp-a-sodium CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-ep-imp-b CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 atorvastatin-ep-imp-c CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 atorvastatin-ep-imp-c-sodium CC(C)C(=O)C1(OC1(C(=O)C1=CC=C(F)C=C1)C1=CC=CC=C1)C(=O)NC1=CC=CC=C1 atorvastatin-ep-imp-d CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@H](O)C[C@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-ep-imp-e CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)NCC[C@@H](O)C[C@@H](O)CC(O)=O)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-ep-imp-f CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)NCC[C@@H](O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-ep-imp-f-sodium CO[C@H](C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(=C1C1=CC=C(F)C=C1)C1=CC=CC=C1)CC(O)=O atorvastatin-ep-imp-g CO[C@H](C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(=C1C1=CC=C(F)C=C1)C1=CC=CC=C1)CC(=O)O[Na] atorvastatin-ep-imp-g-sodium CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H]1C[C@@H](O)CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-ep-imp-h-lactone CCOC(=O)C[C@H](O)C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(=C1C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-et CCOC(=O)\C=C\C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(C2=CC=CC=C2)=C1C1=CC=C(F)C=C1 atorvastatin-et-ester-dehydro CC(C)OC(=O)C[C@H](O)C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(=C1C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-isopropyl CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H]1C[C@@H](O)CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone CC(C)C1=C(C(=O)NC2=C(O)C=CC=C2)C(=C(N1CC[C@@H]1C[C@@H](O)CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone-2-OH CC(C)C1=C(C(=O)NC2=CC=C(O)C=C2)C(=C(N1CC[C@@H]1C[C@@H](O)CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone-4-OH CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H]1CC=CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone-anhydro CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H]1CC=CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone-dehydro CC(C)C1=C(C(=O)NC2=C(O)C=CC=C2)C(=C(N1CC[C@@H]1C[C@@H](O)CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone-o-oh CC(C)C1=C(C(=O)NC2=CC=C(O)C=C2)C(=C(N1CC[C@@H]1C[C@@H](O)CC(=O)O1)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-lactone-p-oh COC(=O)C[C@H](O)C[C@H](O)CCN1C(C(C)C)=C(C(=O)NC2=CC=CC=C2)C(=C1C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-me CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-na CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)CC(=O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-na-3-oxo CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CCC(=O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-na-5-oxo CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)O[Na])C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-sodium CC(C)C1=C(C(=O)NC2=CC=CC=C2)C(=C(N1CC[C@@H](O)C[C@@H](O)CC(=O)OC(C)(C)C)C1=CC=C(F)C=C1)C1=CC=CC=C1 atorvastatin-t-bt C[C@H]1[C@]([H])(NC(=O)C(=N/OC(C)(C)C(=O)O)\C2=CSC(N)=N2)C(=O)N1S(=O)(=O)O aztreonam C[C@H]1[C@]([H])(NC(=O)C(=N/OC(C)(C)C(O)=O)\C2=CSC(N)=N2)C(=O)N1S(=O)(=O)O aztreonam-api [Na]OC(=O)C(C)(C)O\N=C(/C(=O)N[C@@]1([H])[C@H](C)N(C1=O)S(=O)(=O)O[Na])C1=CSC(N)=N1 aztreonam-disodium C[C@H]1[C@]([H])(NC(=O)C(=N\OC(C)(C)C(O)=O)\C2=CSC(N)=N2)C(=O)N1S(=O)(=O)O aztreonam-e-isomer CN1C(CCCC(O)=O)=NC2=CC(=CC=C12)N(CCCl)CCCl bendamustine-api CN1C(CCCC(O)=O)=NC2=CC(=CC=C12)N(CCO)CCO bendamustine-dihydroxy CCOC(=O)CCCC1=NC2=CC(=CC=C2N1C)N(CCCl)CCCl bendamustine-ethyl-ester CC(C)OC(=O)CCCC1=NC2=CC(=CC=C2N1C)N(CCCl)CCCl bendamustine-isopropyl CC(C)OC(=O)CCCC1=NC2=CC(=CC=C2N1C)N(CCCl)CCCl bendamustine-isopropyl-ester COC(=O)CCCC1=NC2=CC(=CC=C2N1C)N(CCCl)CCCl bendamustine-methyl-ester CCCCOS(=O)(=O)C1=CC=CC=C1 benzenesulfonate-butyl CCOS(=O)(=O)C1=CC=CC=C1 benzenesulfonate-ethyl CC(C)OS(=O)(=O)C1=CC=CC=C1 benzenesulfonate-isopropyl COS(=O)(=O)C1=CC=CC=C1 benzenesulfonate-methyl CC(O)(CS(=O)(=O)C1=CC=CC=C1F)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-2-fluoro CC(O)(CS(=O)(=O)C1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-api CC(O)(CS(=O)(=O)C1=CC=CC=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-desfluoro CC(CS(=O)(=O)C1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-deshydroxy C[C@@](O)(CS(=O)(=O)C1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-r C[C@](O)(CS(=O)(=O)C1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-s CC(O)(CSC1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-sulfide CC(O)(CS(=O)C1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F bicalutamide-sulfoxide CCOCCO[C@@H]1CCC(C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)C[C@H]1OC biolimus-A9 [H][C@]12CS[C@@]([H])(CCCCC(O)=O)[C@@]1([H])NC(=O)N2 biotin OCC1=CC=C(O)C=C1 bisoprolol-alcohol OC1=CC=C(C=O)C=C1 bisoprolol-aldehyde CC(C)NCC(O)COC1=CC=C(COCCOC(C)C)C=C1 bisoprolol-base CC(C)NCC(O)COC1=CC=C(CO)C=C1 bisoprolol-ep-imp-a CCCOCCOCC1=CC=C(OCC(O)CNC(C)C)C=C1 bisoprolol-ep-imp-b CC(C)NCC(O)COC1=CC=C(CC2=CC=C(OCC(O)CNC(C)C)C=C2)C=C1 bisoprolol-ep-imp-c CC(C)NCC(O)COC1=CC=C(COCOCCOC(C)C)C=C1 bisoprolol-ep-imp-g CC(C)OCCOCC1=CC=C(OCC(O)CO)C=C1 bisoprolol-ep-imp-j CC(C)NCC(O)COC1=CC=C(C=C1)C(=O)OCCOC(C)C bisoprolol-ep-imp-k Cl.CC(C)NCC(O)COC1=CC=C(C=O)C=C1 bisoprolol-ep-imp-l CC(C)OCCOCC1=CC=C(O)C=C1 bisoprolol-ep-imp-m CCOCCOCC1=CC=C(OCC(O)CNC(C)C)C=C1 bisoprolol-ep-imp-n COCCOCC1=CC=C(OCC(O)CNC(C)C)C=C1 bisoprolol-ep-imp-q OC1=CC=C(C=O)C=C1 bisoprolol-ep-imp-s CC(C)OCCOCC1=CC=C(OCC2CO2)C=C1 bisoprolol-epoxide [H][C@@]12CCCN1C(=O)[C@H](CC(C)C)N1C(=O)[C@](NC(=O)[C@H]3CN(C)[C@]4([H])CC5=C(Br)NC6=CC=CC(=C56)C4=C3)(O[C@@]21O)C(C)C bromocriptine-base CS(O)(=O)=O.[H][C@@]12CCCN1C(=O)[C@H](CC(C)C)N1C(=O)[C@](NC(=O)[C@H]3CN(C)[C@]4([H])CC5=C(Br)NC6=CC=CC(=C56)C4=C3)(O[C@@]21O)C(C)C bromocriptine-methylate CC(Br)C(=O)C1=CC(Cl)=CC=C1 bupropion-1-one-2-bromo Cl.CC(NC(C)(C)C)C(=O)C1=C(Cl)C=CC=C1 bupropion-2-chloro Cl.CC(NC(C)(C)C)C(=O)C1=CC(Cl)=C(Cl)C=C1 bupropion-3-4-dichloro Cl.CC(NC(C)(C)C)C(=O)C1=CC(Cl)=CC(Cl)=C1 bupropion-3-5-dichloro CCC(=O)C1=CC(Cl)=CC=C1 bupropion-3-chloropropiophenone Cl.CC(N)C(=O)C1=CC(Cl)=CC=C1 bupropion-amino Cl.CC(NC(C)(C)C)C(=O)C1=CC(Cl)=CC=C1 bupropion-hcl Cl.C[C@@H]1NC(C)(C)CO[C@@]1(O)C1=CC(Cl)=CC=C1 bupropion-morpholinol CC(NC(C)(C)C)C(=O)C1=CC=C(Cl)C=C1 bupropion-usp-rc-a-base Cl.CC(NC(C)(C)C)C(=O)C1=CC=C(Cl)C=C1 bupropion-usp-rc-a-hcl Cl.CC(NC(C)(C)C)C(=O)C1=CC(Br)=CC=C1 bupropion-usp-rc-b CC(O)C(=O)C1=CC(Cl)=CC=C1 bupropion-usp-rc-c Cl.CC(NC(C)(C)C)C(=O)C1=CC=CC=C1 bupropion-usp-rc-d CC(=O)C(=O)C1=CC(Cl)=CC=C1 bupropion-usp-rc-e CC(=O)C(O)C1=CC(Cl)=CC=C1 bupropion-usp-rc-f CCCCOS(=O)(=O)C1=CC=CC=C1 butyl-benzenesulfonate CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC(O)=C4)N=C13)C2=O camptothecin-10-oh CCC1=C2CN3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=C1C=CC=C2 camptothecin-7-et CCC1=C2CN3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=C1C=C(O)C=C2 camptothecin-7-et-10-oh CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC=C4)N=C13)C2=O camptothecin-base CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC=C4)N=C13)C2=O camptothecin-str CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(O)=O candesartan CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(O)=O candesartan-api CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1CC)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil-1-ethyl CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN(CC)N=N1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil-2-ethyl CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil-api CC(OC(=O)OC1CCCCC1)OC(=O)C1=CC=CC2=C1N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(O)=N2 candesartan-cilexetil-desethyl CCN1N=NN=C1C1=CC=CC=C1C1=CC=C(CN2C(=O)NC3=C2C(=CC=C3)C(=O)OC(C)OC(=O)OC2CCCCC2)C=C1 candesartan-cilexetil-desethyl-1-ethyl CCN1N=NC(=N1)C1=CC=CC=C1C1=CC=C(CN2C(=O)NC3=C2C(=CC=C3)C(=O)OC(C)OC(=O)OC2CCCCC2)C=C1 candesartan-cilexetil-desethyl-2-ethyl COC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil-methox COC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil-methoxy Cl.COC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-cilexetil-methoxy-hcl OC(=O)C1=CC=CC2=C1N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(O)=N2 candesartan-desethyl CCOC(=O)C1=CC=CC2=C1N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(OCC)=N2 candesartan-ethyl-ester COC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 candesartan-imp-tritylmethyl-ether CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(=CC=C2)C(=O)OC candesartan-methyl-ester CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)C(O)=O candesartan-trityl CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)C(=O)OC(C)OC(=O)OC1CCCCC1 candesartan-trityl-cilexetil CCOC(=O)C1=CC=CC2=C1N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C(OCC)=N2 candesartan-trityl-ethyl-ester CCOC1=NC2=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)C(O)=O candesartan-trityl-str C[C@]12CCC3C(C=CC4=CC(=O)CC[C@]34C)C1CC[C@@]21CCC(=O)O1 canrenone C[C@H](CS)C(=O)N1CCC[C@H]1C(O)=O captopril-api C[C@H](CSSC[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O)C(=O)N1CCC[C@H]1C(O)=O captopril-disulfide C[C@H](CS)C(O)=O captopril-mmpa C[C@H](CS)C(O)=O.NC(CC1=CC=CC=C1)C1=CC=CC=C1 captopril-mmpa-dpea CSC[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O captopril-s-methyl C[C@H](CS(C)=O)C(=O)N1CCC[C@H]1C(O)=O captopril-s-methyl-sulfoxide COC1=C(OCCNCC(O)COC2=CC=CC3=C2C2=C(N3)C=CC=C2)C=CC=C1 carvedilol COC1=C(OCCN)C=CC=C1 carvedilol-amine COC1=CC=CC=C1OCCNCC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1 carvedilol-api COC1=C(OCCNCC(O)COC2=CC=CC3=C2C2=C(C=CC=C2)N3CC(O)CNCCOC2=C(OC)C=CC=C2)C=CC=C1 carvedilol-ep-imp-a COC1=CC=CC=C1OCCNCC(O)CN(CCOC1=CC=CC=C1OC)CC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1 carvedilol-ep-imp-b COC1=CC=CC=C1OCCN(CC(O)COC1=CC=CC2=C1C1=C(N2)C=CC=C1)CC1=CC=CC=C1 carvedilol-ep-imp-c C(OC1=CC=CC2=C1C1=C(N2)C=CC=C1)C1CO1 carvedilol-epoxy OC1=CC=CC2=C1C1=C(N2)C=CC=C1 carvedilol-oh COC1=C(OCCNC[C@H](O)COC2=CC=CC3=C2C2=C(N3)C=CC=C2)C=CC=C1 carvedilol-r COC1=C(OCCNC[C@@H](O)COC2=CC=CC3=C2C2=C(N3)C=CC=C2)C=CC=C1 carvedilol-s C.OC=O.CC(O)=O.CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](NCCN)NC(=O)C2[C@@H](O)CCN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C=C1)[C@H](O)CCN caspofungin-acetate CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](NCCN)NC(=O)C2[C@@H](O)CCN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C=C1)[C@H](O)CCN caspofungin-base [H][C@]12SCC(Cl)=C(N1C(=O)[C@@]2([H])NC(=O)[C@@H](N)C1=CC=CC=C1)C(O)=O cefaclor-2S-isomer O.[H][C@@]1(NC(=O)[C@H](N)C2=CC=CC=C2)C(=O)N2C(C(O)=O)=C(Cl)CS[C@]12[H] cefaclor-api N[C@@H](C(O)=O)C1=CC=CC=C1 cefaclor-ep-imp-a [H][C@@]1(N)C(=O)N2C(C(O)=O)=C(Cl)CS[C@]12[H] cefaclor-ep-imp-b [H][C@]12SCC(Cl)=C(N1C(=O)[C@@]2([H])NC(=O)[C@@H](N)C1=CC=CC=C1)C(O)=O cefaclor-ep-imp-c [H][C@]12SCC(CSC3=NN=NN3C)=C(N1C(=O)[C@@]2([H])NC(=O)[C@H](O)C1=CC=CC=C1)C(O)=O cefamandole-acid [H][C@@]1(NC(=O)[C@H](OC=O)C2=CC=CC=C2)C(=O)N2C(C(=O)O[Na])=C(CSC3=NN=NN3C)CS[C@]12[H] cefamandole-nafate [H][C@@]1(NC(=O)[C@H](O)C2=CC=CC=C2)C(=O)N2C(C(=O)O[Na])=C(CSC3=NN=NN3C)CS[C@]12[H] cefamandole-sodium [H][C@@]1(NC(=O)CN2C=NN=N2)C(=O)N2C(C(O)=O)=C(CSC3=NN=C(C)S3)CS[C@]12[H] cefazolin-acid [H][C@@]1(NC(=O)CN2C=NN=N2)C(=O)N2C(C(=O)O[Na])=C(CSC3=NN=C(C)S3)CS[C@]12[H] cefazolin-sodium CO\N=C(/C(=O)N[C@]1([H])C(=O)N2C(C(=O)O)=C(CS[C@]12[H])C[N]1(C)CCCC1)C1=CSC(N)=N1 cefepime-hcl O.O.O.C=CC1=C(C(=O)O)N2C(=O)[C@@]([H])(NC(=O)C(=N/OCC(=O)O)\C3=CSC(N)=N3)[C@@]2([H])SC1 cefixime-trihydrate [H][C@]12SCC(CSC3=NN=NN3C)=C(N1C(=O)[C@]2(NC(=O)CSCC#N)OC)C(O)=O cefmetazole-acid [H][C@]12SCC(CSC3=NN=NN3C)=C(N1C(=O)[C@]2(NC(=O)CSCC#N)OC)C(=O)O[Na] cefmetazole-sodium [H][C@@]1(NC(=O)C(=N/OC)\C2=CSC(N)=N2)C(=O)N2C(C(O)=O)=C(COC(C)=O)CS[C@]12[H] cefotaxime-acid [H][C@@]1(NC(=O)C(=N/OC)\C2=CSC(N)=N2)C(=O)N2C(C(=O)O[Na])=C(COC(C)=O)CS[C@]12[H] cefotaxime-sodium [H][C@]12SCC(COC(N)=O)=C(N1C(=O)[C@]2(NC(=O)CC1=CC=CS1)OC)C(O)=O cefoxitin-acid [H][C@]12SCC(COC(N)=O)=C(N1C(=O)[C@]2(NC(=O)CC1=CC=CS1)OC)C(=O)O[Na] cefoxitin-sodium [H][C@]12SCC(C[NH]3=CC=C(C=C3)C(N)=O)=C(N1C(=O)[C@@]2([H])NC(=O)[C@@H](C1=CC=CC=C1)S(O)(=O)=O)C(O)=O cefsulodin-acid [H][C@@]1(NC(=O)[C@@H](C2=CC=CC=C2)S(=O)(=O)O[Na])C(=O)N2C(C(O)=O)=C(C[NH]3=CC=C(C=C3)C(N)=O)CS[C@]12[H] cefsulodin-sodium [H][C@@]1(NC(=O)C(=N/OC)\C2=CSC(N)=N2)C(=O)N2C(C(O)=O)=C(CSC(=O)C3=CC=CO3)CS[C@]12[H] ceftiofur-acid Cl.[H][C@@]1(NC(=O)C(=N/OC)\C2=CSC(N)=N2)C(=O)N2C(C(O)=O)=C(CSC(=O)C3=CC=CO3)CS[C@]12[H] ceftiofur-hcl [H][C@@]1(NC(=O)C(=N/OC)\C2=CSC(N)=N2)C(=O)N2C(C(=O)O[Na])=C(CSC(=O)C3=CC=CO3)CS[C@]12[H] ceftiofur-sodium [H][C@@]1(NC(=O)C(=N/OC)\C2=CC=CO2)C(=O)N2C(C(O)=O)=C(COC(N)=O)CS[C@]12[H] cefuroxime-acid [H][C@@]1(NC(=O)C(=N/OC)\C2=CC=CO2)C(=O)N2C(C(=O)OC(C)OC(C)=O)=C(COC(N)=O)CS[C@]12[H] cefuroxime-axetil [H][C@@]1(NC(=O)C(=N/OC)\C2=CC=CO2)C(=O)N2C(C(=O)O[Na])=C(COC(N)=O)CS[C@]12[H] cefuroxime-sodium CNC(=N)NC(=N)NC1=CC=C(Cl)C=C1.CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1 chlorhexidine CNC(N)=N.CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1 chlorhexidine-impurity-G352 N[C@H](CSCCCC\C=C(/NC(=O)[C@H]1CC1(C)C)C(=O)O)C(=O)O cilastatin-acid [Na]OC(=O)C(=C\CCCCSC[C@@H](N)C(=O)O)\NC(=O)[C@H]1CC1(C)C cilastatin-sodium [H][C@@]12C[C@@H](O)CN1C(=O)[C@@]([H])(NC(=O)[C@H](C[C@@H](O)[C@@H](O)NC(=O)[C@]1([H])[C@@H](O)[C@@H](C)CN1C(=O)[C@@]([H])(NC(=O)[C@@]([H])(NC2=O)[C@H](O)[C@H](O)C1=CC=C(O)C=C1)[C@@H](C)O)NC(=O)C1=CC=C(CCCCCCCC)C=C1)[C@@H](C)O cilofungin C(\C=C\C1=CC=CC=C1)N1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-api C(\C=C/C1=CC=CC=C1)N1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-cis C1CN(CCN1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-ep-imp-a C(\C=C/C1=CC=CC=C1)N1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-ep-imp-b C(\C=C\C1=CC=CC=C1)[N]1(C\C=C\C2=CC=CC=C2)CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-ep-imp-c C(\C=C\C1=CC=CC=C1)C(\C=C\C1=CC=CC=C1)N1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-ep-imp-d C1CN(CCN1C(C1=CC=CC=C1)C1=CC=CC=C1)C(C1=CC=CC=C1)C1=CC=CC=C1 cinnarizine-ep-imp-e OC(=O)C1=CN(C2CC2)C2=C(C=C(F)C(=C2)N2CCNCC2)C1=O ciprofloxacin-api OC(=O)C1=CN(C2CC2)C2=C(C=C(F)C(Cl)=C2)C1=O ciprofloxacin-ep-imp-a OC(=O)C1=CN(C2CC2)C2=C(C=CC(=C2)N2CCNCC2)C1=O ciprofloxacin-ep-imp-b Cl.OC(=O)C1=CN(C2CC2)C2=C(C=CC(=C2)N2CCNCC2)C1=O ciprofloxacin-ep-imp-b-hcl NCCNC1=CC2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O ciprofloxacin-ep-imp-c OC(=O)C1=CN(C2CC2)C2=C(C=C(N3CCNCC3)C(Cl)=C2)C1=O ciprofloxacin-ep-imp-d NCCNC1=CC2=C(C=C1Cl)N(C=C(C(O)=O)C2=O)C1CC1 ciprofloxacin-ep-imp-d-desethylene FC1=CC2=C(C=C1N1CCNCC1)N(C=CC2=O)C1CC1 ciprofloxacin-ep-imp-e O.Cl.OC(=O)C1=CN(C2CC2)C2=C(C=C(F)C(=C2)N2CCNCC2)C1=O ciprofloxacin-hcl-h2o CN(C)CCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1 citalopram-base NCCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1 citalopram-didesmethyl CN(C)CCCC(O)(C1=CC=C(F)C=C1)C1=CC=C(C=C1CO)[N]#C citalopram-diol CN(C)CCCC1(OCC2=CC(=CC=C12)C(N)=O)C1=CC=C(F)C=C1 citalopram-ep-imp-a CN(C)CCCC1(OC(O)C2=CC(=CC=C12)C#N)C1=CC=C(F)C=C1 citalopram-ep-imp-b CN(C)CCCC1(OC(=O)C2=CC(=CC=C12)C#N)C1=CC=C(F)C=C1 citalopram-ep-imp-c CNCCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1 citalopram-ep-imp-d CN(C)CCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1>O> citalopram-ep-imp-e CN(C)CCCC1(OCC2=CC(Br)=CC=C12)C1=CC=C(F)C=C1 citalopram-ep-imp-f CN(C)CCCC(=O)C1=CC=C2C(COC2(CCCN(C)C)C2=CC=C(F)C=C2)=C1 citalopram-ep-imp-g Br.CN(C)CCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1 citalopram-hbr Cl.CNCCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1 citalopram-n-desmethyl CN(C)CCCC1(OCC2=CC(=CC=C12)[N]#C)C1=CC=C(F)C=C1>O> citalopram-n-oxide CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2CC(C)(OC)C(O)C(C)O2)C(C)[C@@H](OC2OC(C)CC(C2O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)OC clarithromycin-api [H][C@@]12CC(=O)N1[C@@]([H])(C(=O)O[K])\C(O2)=C\CO clavulanate-potassium CCCC1C[C@@H](N(C)C1)C(=O)NC(C(C)Cl)C1O[C@H](SC)C(O)C(O)[C@H]1O clindamycin-api Cl.CCCC1C[C@@H](N(C)C1)C(=O)NC(C(C)Cl)C1O[C@@H](C(O)C(O)[C@H]1O)S(C)=O clindamycin-sulfoxide-hcl ClC1=CC=C(C=C1)C(OCCN1CCCCC1)C1=CC=CC=C1.OC(=O)C1=CC=CC=C1C(=O)C1=CC(=C(O)C=C1)C1=CC=CC=C1 cloperastine-fendizoate Cl.ClC1=CC=C(C=C1)C(OCCN1CCCCC1)C1=CC=CC=C1 cloperastine-hcl OC(=O)[C@H](N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-R-acid OC(=O)C(N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-acid-racemate COC(=O)[C@@H](N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-base ClC1=C(C=CC=C1)C(C#N)N1CCC2=C(C1)C=CS2 clopidogrel-cyano COC(=O)C(N1CCC(S)\C(C1)=C/C(O)=O)C1=C(Cl)C=CC=C1 clopidogrel-h4 Cl.COC(=O)C(N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-hcl-racemate Cl.COC(=O)C(N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-hcl-racemic Cl.COC(=O)[C@@H](NCCC1=CC=CS1)C1=C(Cl)C=CC=C1 clopidogrel-mte COC(=O)C(N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-racemate Cl.C1CC2=C(CN1)C=CS2 clopidogrel-ttp Cl.OC(=O)[C@@H](N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-usp-rc-a Cl.COC(=O)C(N1CCC2=C(C1)SC=C2)C1=C(Cl)C=CC=C1 clopidogrel-usp-rc-b OOS(O)=O.COC(=O)[C@H](N1CCC2=C(C1)C=CS2)C1=C(Cl)C=CC=C1 clopidogrel-usp-rc-c CN1CCN(CC1)C1=NC2=C(NC3=C1C=CC=C3)C=CC(Cl)=C2 clozapine-api ClC1=CC2=C(NC3=C(C=CC=C3)C(=O)N2)C=C1 clozapine-ep-imp-a ClC1=CC2=C(NC3=CC=CC=C3C(=N2)N2CCN(CC2)C2=NC3=C(NC4=C2C=CC=C4)C=CC(Cl)=C3)C=C1 clozapine-ep-imp-b OC1=CC2=C(NC3=C(C=CC=C3)C(=N2)N2CCNCC2)C=C1.ClC1=CC2=C(NC3=C(C=CC=C3)C(=N2)N2CCNCC2)C=C1.CN1CCN(CC1)C1=NC2=C(NC3=C1C=CC=C3)C=CC(O)=C2.CN1CCN(CC1)C1=NC2=C(NC3=C1C=CC=C3)C=C(O)C(Cl)=C2 clozapine-metabolites-str ClC1=CC2=C(NC3=C(C=CC=C3)C(=N2)N2CCNCC2)C=C1 clozapine-n-desmethyl CC(CN(C)C)CN1C2=C(SC3=C1C=C(C=C3)C#N)C=CC=C2 cyamemazine-base ClC1=CC2=C(SC3=C(N2)C=CC=C3)C=C1 cyamemazine-cl-pt N#CC1=CC2=C(SC3=C(N2)C=CC=C3)C=C1 cyamemazine-cpt OC(=O)\C=C/C(O)=O.CC(CN(C)C)CN1C2=C(SC3=C1C=C(C=C3)C#N)C=CC=C2 cyamemazine-maleate OC(C(O)C(O)=O)C(O)=O.CC(CN(C)C)CN1C2=C(SC3=C1C=C(C=C3)C#N)C=CC=C2 cyamemazine-tartrate CCN(CC)CCS(=O)(=O)[C@@H]1CCN2C(=O)C3=COC(=N3)CC(=O)C[C@H](O)\C=C(/C)\C=C\CNC(=O)\C=C\[C@@H](C)[C@@H](C(C)C)OC(=O)[C@@H]12 dalfopristin-api NC1=NC(=O)N(C=N1)[C@H]1CC(O)[C@@H](CO)O1 decitabine-api CC(C)C1=CC2=C(C=C1)[C@@]1(C)CCC[C@](C)(C1CC2)C(O)=O dehydroabietic-acid OCC1NCC(O)C(O)C1O deoxynojirimycin OC1=CC2=C(N=C1)C(=C1CCNCC1)C1=C(CC2)C=C(Cl)C=C1 desloratadine-3-oh BrC1=CC2=C(C=C1)C(=C1CCNCC1)C1=C(CC2)C=CC=N1 desloratadine-8-bromo ClC1=CC2=C(C=C1)C(=C1CCNCC1)C1=C(CC2)C=CC=N1 desloratadine-api FC1(C2CCNCC2)C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 desloratadine-fluoro ClC1=CC2=C(C=C1)C(C1=CCNCC1)C1=C(CC2)C=CC=N1 desloratadine-isomer CC(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 desloratadine-n-acetyl ClC1=CC2=C(C=C1)C(=C1CCN(CC1)C=O)C1=C(CC2)C=CC=N1 desloratadine-n-formyl OC(CCN1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2)C(O)=O desloratadine-n-hydroxybutanoic CN1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 desloratadine-n-me ON1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 desloratadine-n-oh OC(=O)CCN1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 desloratadine-n-propionic ClC1=CC2=C(C=C1)C(C1=CC=NC=C1)C1=C(CC2)C=CC=N1>>O desloratadine-pyridine-n-oxide BrC1=CC2=C(C=C1)C(=C1CCNCC1)C1=C(CC2)C=CC=N1 desloratadine-usp-rc-a CC1(C)COC(=O)[C@@H]1O dexpanthenol-R-pantolactone CC(C)(CO)[C@@H](O)C(=O)NCCCO dexpanthenol-api CC(C)(CO)C(O)C(=O)NCCCO dexpanthenol-racemic CC(=O)OC1=CC=CC2=C1C(=O)C1=C(C=C(C=C1OC(C)=O)C(O)=O)C2=O diacerein-api OC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 diclofenac-api ClC1=CC=CC(Cl)=C1N1C(=O)CC2=C1C=CC=C2 diclofenac-ep-imp-a ClC1=CC=CC(Cl)=C1NC1=C(C=O)C=CC=C1 diclofenac-ep-imp-b OCC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 diclofenac-ep-imp-c OC(=O)CC1=C(NC2=C(Br)C=CC=C2Cl)C=CC=C1 diclofenac-ep-imp-d O=C1CC2=C(N1)C=CC=C2 diclofenac-ep-imp-e ClC1=CC=CC(Cl)=C1NC1=C(CC(=O)O[K])C=CC=C1 diclofenac-potassium [Na]OC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1 diclofenac-sodium Cl.COC1=CC=C(C=C1)[C@@H]1SC2=CC=CC=C2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O diltiazem-hcl Cl.CNCCN1C2=CC=CC=C2S[C@H]([C@@H](OC(C)=O)C1=O)C1=CC=C(OC)C=C1 diltiazem-n-desmethyl-hcl Cl.COC1=CC=C(C=C1)[C@@H]1SC2=CC=CC=C2N(CCN)C(=O)[C@@H]1OC(C)=O diltiazem-n-didesmethyl-hcl Cl.COC1=CC=C(C=C1)[C@@H]1SC2=CC=CC=C2N(CCN(C)C)C(=O)[C@@H]1O diltiazem-o-desacetyl-hcl OCCN(CCO)C1=NC2=C(N=C(N=C2N2CCCCC2)N(CCO)CCO)C(=N1)N1CCCCC1 dipyridamole-api OCCN(CCO)C1=NC2=C(N=C(Cl)N=C2N2CCCCC2)C(=N1)N1CCCCC1 dipyridamole-chloro-dp OCCN(CCO)C1=NC2=C(N=C(N=C2N2CCCCC2)N2CCCCC2)C(=N1)N1CCCCC1 dipyridamole-ep-imp-a OCCN(CCO)C1=NC2=C(N=C(N=C2N2CCCCC2)N(CCO)CCO)C(=N1)N(CCO)CCO dipyridamole-ep-imp-b OCCN(CCO)C1=NC2=C(N=C(Cl)N=C2N2CCCCC2)C(=N1)N1CCCCC1 dipyridamole-ep-imp-c OCCNC1=NC2=C(N=C(N=C2N2CCCCC2)N(CCO)CCO)C(=N1)N1CCCCC1 dipyridamole-ep-imp-d OCCN(CCO)C1=NC2=C(N=C(N=C2N2CCCCC2)N2CCCCC2)C(=N1)N(CCO)CCO dipyridamole-ep-imp-e OCCNC1=NC2=C(N=C(N=C2N2CCCCC2)N(CCO)CCO)C(=N1)N(CCO)CCO dipyridamole-ep-imp-f ClC1=NC2=C(N=C(Cl)N=C2N2CCCCC2)C(=N1)N1CCCCC1 dipyridamole-ep-imp-g OCCN(CCO)C1=NC2=C(N=C(N=C2N(CCO)CCO)N2CCCCC2)C(=N1)N1CCCCC1 dipyridamole-isomer ClC1=NC2=C(N=C(Cl)N=C2Cl)C(Cl)=N1 dipyridamole-tetrachloro ClC1=NC2=C(N=C(Cl)N=C2N2CCCCC2)C(Cl)=N1 dipyridamole-trichloro-mp [H]C12[C@H](OC(=O)C3=CC=CC=C3)[C@]3(O)C[C@H](O)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@@]21OC(C)=O)C3(C)C>>[H]C12[C@H](OC(=O)C3=CC=CC=C3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(C)=O)C4=CC=CC=C4)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@@]21OC(C)=O)C3(C)C.CC(C)(C)OC(=O)N[C@H]([C@@H](O)C(O)=O)C1=CC=CC=C1.CC(C)(C)O docetaxel-ros COC1=C(OC)C=C2C(=O)C(CC3CCN(CC4=CC=CC=C4)CC3)CC2=C1 donepezil-base COC1=C(OC)C=C2C(=O)C(CC3CCN(CC4=CC=CC=C4)CC3)=CC2=C1 donepezil-dehydro Cl.COC1=C(OC)C=C2C(=O)C(CC3CCN(CC4=CC=CC=C4)CC3)CC2=C1 donepezil-hcl O.[H][C@]12[C@@H](C)C(S[C@@H]3CN[C@H](CNS(N)(=O)=O)C3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O doripenem-monohydrate Cl.CNCC[C@H](OC1=C2C=CC=CC2=CC=C1)C1=CC=CS1 duloxetine-base Cl.CNCC[C@H](OC1=C2C=CC=CC2=CC=C1)C1=CC=CS1 duloxetine-hcl NCC[C@H](OC1=C2C=CC=CC2=CC=C1)C1=CC=CS1 duloxetine-n-desmethyl CN(C)CC[C@H](OC1=C2C=CC=CC2=CC=C1)C1=CC=CS1 duloxetine-n-methyl CN(C)CC[C@H](O)C1=CC=CS1 duloxetine-thio CCCCC\C=C/C\C=C/CCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@H](O)C1=CC=C(O)C=C1)[C@@H](C)O>>CCCCCOC1=CC=C(C=C1)C1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@H](O)C1=CC=C(O)C=C1)[C@@H](C)O echinocandin-b-anidulafungin C[C@@H](O)C1NC(=O)[C@@H](N)C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C1=O)[C@H](O)[C@H](O)C1=CC=C(O)C=C1)[C@@H](C)O echinocandin-b-nucleus CCCCC\C=C/C\C=C/CCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@H](O)C1=CC=C(O)C=C1)[C@@H](C)O echinocandin-b-str CC1=CC2=C(C(O)=C1)C(=O)C1=C(C=C(O)C=C1O)C2=O emodin C[C@H](N)C(=O)N1CCCC1C(O)=O.C[C@H](N)C(=O)N1CCCC1C(O)=O.CCOC(=O)[C@H](O)CCC1=CC=CC=C1.CCOC(=O)C(Br)CCC1=CC=CC=C1.CCOC(=O)[C@H](Br)CCC1=CC=CC=C1.CCOC(=O)[C@@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(O)=O enalapril-R-isomer-ros CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(O)=O enalapril-base CCOC(=O)[C@H](N)CCC1=CC=CC=C1 enalapril-ecppa-r CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 enalapril-ecppa-s CCOC(=O)[C@@H](CCC1=CC=CC=C1)N[C@H](C)C(O)=O enalapril-ecppap-rr CCOC(=O)[C@@H](CCC1=CC=CC=C1)N[C@@H](C)C(O)=O enalapril-ecppap-rs CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H](C)C(O)=O enalapril-ecppap-sr CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(O)=O enalapril-ecppap-ss CCOC(=O)[C@@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(O)=O enalapril-ep-imp-a CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(O)=O enalapril-ep-imp-b C[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCCC1C(O)=O enalapril-ep-imp-c CCOC(=O)[C@H](CCC1=CC=CC=C1)N1[C@@H](C)C(=O)N2CCC[C@H]2C1=O enalapril-ep-imp-d C[C@H](N[C@@H](CCC1=CC=CC=C1)C(=O)OCCC1=CC=CC=C1)C(=O)N1CCCC1C(O)=O enalapril-ep-imp-e CCCCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(O)=O enalapril-ep-imp-f CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(O)=O enalapril-ep-imp-g CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1CCCC1C(O)=O enalapril-ep-imp-h O=C(O)\C=C/C(=O)O.CCOC(=O)[C@H](CCC1CCCCC1)N[C@@H](C)C(=O)N1CCCC1C(=O)O enalapril-ep-imp-h-maleate O=C(O)\C=C/C(=O)O.CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(=O)O enalapril-maleate O=C(O)\C=C/C(=O)O.CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(=O)O enalapril-maleate-number CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N1CCCC1C(=O)O[Na] enalapril-sodium-number NC1=NC(=O)C2=C(N1)N(C=N2)C1C[C@@H](O)[C@@H](CO)C1=C entecavir-1R-3S-4R NC1=NC(=O)C2=C(N1)N(C=N2)C1C[C@H](O)[C@@H](CO)C1=C entecavir-api NC1=NC(=O)C2=C(N1)N(C=N2)C1C[C@H](OCC2=CC=CC=C2)[C@@H](COCC2=CC=CC=C2)C1=C>>NC1=NC(=O)C2=C(N1)N(C=N2)C1C[C@H](O)[C@@H](CO)C1=C entecavir-ros NC1=NC(=O)C2=C(N1)N(C=N2)C1C[C@H](O)[C@@H](CO)C1=C.NC1=NC2=C(N=CN2C2C[C@H](OC(=O)C3=CC=CC=C3)[C@@H](COC(=O)C3=CC=CC=C3)C2=C)C(OC(=O)C2=CC=CC=C2)=N1.COC1=CC=C(C=C1)C(NC1=NC2=C(N=CN2C2C[C@H](OC(=O)C3=CC=CC=C3)[C@@H](COC(=O)C3=CC=CC=C3)[C@@H]2O)C(OC(=O)C2=CC=CC=C2)=N1)(C1=CC=CC=C1)C1=CC=CC=C1.COC1=CC=C(C=C1)C(NC1=NC2=C(N=CN2C2C[C@H](OC(=O)C3=CC=CC=C3)[C@@H](COC(=O)C3=CC=CC=C3)C2=C)C(OC(=O)C2=CC=CC=C2)=N1)(C1=CC=CC=C1)C1=CC=CC=C1.COC1=CC=C(C=C1)C(NC1=NC2=C(N=CN2C2C[C@H](OC(=O)C3=CC=CC=C3)[C@@H](COC(=O)C3=CC=CC=C3)C2=O)C(OC(=O)C2=CC=CC=C2)=N1)(C1=CC=CC=C1)C1=CC=CC=C1 entecavir-ros-100113 [H][C@@]12CC[C@]3(CCC(=O)O3)[C@@]1(C)C[C@H]1O[C@@]11C2[C@@H](CC2=CC(=O)CC[C@]12C)C(=O)OC eplerenone [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)C[C@H]1O[C@@]11C2[C@@H](CC2=CC(=O)CC[C@]12C)C(=O)OC eplerenone-api [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)C[C@@H](O)C1C2C=CC2=CC(=O)CC[C@]12C eplerenone-int-11-oh-canrenone [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CCC1C2C=CC2=CC(=O)CC[C@]12C eplerenone-int-canrenone [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC=C1C2C=CC2=CC(=O)CC[C@]12C eplerenone-int-dehydro-canrenone C[C@H]1CCCC2O[C@@]2([H])C[C@]([H])(OC(=O)C[C@H](O)C(C)(C)C(=O)[C@H](C)[C@H]1O)C(\C)=C\C1=CSC(C)=N1 epothilone-a C[C@H]1CCC[C@@]2(C)O[C@@]2([H])C[C@]([H])(OC(=O)C[C@H](O)C(C)(C)C(=O)[C@H](C)[C@H]1O)C(\C)=C\C1=CSC(C)=N1 epothilone-b C[C@]12CCC3C(=CCC4=CC(O)=CC=C34)C1CCC2=O equilin COC1=CC=C2C3CC[C@@]4(C)C(CCC4=O)C3=CCC2=C1 equilin-methyl-ether C[C@]12CCC3C(=CCC4=CC(O)=CC=C34)C1CCC2=O equilin-str COCCOC1=C(OCCOC)C=C2C(=O)NC=NC2=C1 erlotinib-08 COCCOC1=C(OCCOC)C=C2C(Cl)=NC=NC2=C1 erlotinib-09 COCCOC1=C(OCCOC)C=C2C(NC3=CC(=CC=C3)C#C)=NC=NC2=C1 erlotinib-base Cl.COCCOC1=C(OCCOC)C=C2C(NC3=CC(=CC=C3)C#C)=NC=NC2=C1 erlotinib-hcl OCCOC1=C(OCCO)C=C2C(NC3=CC(=CC=C3)C#C)=NC=NC2=C1 erlotinib-m12 COCCOC1=C(OCCO)C=C2N=CN=C(NC3=CC(=CC=C3)C#C)C2=C1 erlotinib-m13 COCCOC1=C(OCCO)C=C2C(NC3=CC(=CC=C3)C#C)=NC=NC2=C1 erlotinib-m14 COCCOC1=C(OCCOC)C=C2C(NC3=CC(C#C)=C(O)C=C3)=NC=NC2=C1 erlotinib-m16 COCCOC1=C(OCCOC)C=C2C(NC3=CC(CC(O)=O)=CC=C3)=NC=NC2=C1 erlotinib-m6 Cl.I.II.I[I]I.NC1=CC(=CC=C1)C#C.COCCOC1=C(OCCOC)C=C2C(=O)NC=NC2=C1.COCCOC1=C(OCCOC)C=C2C(Cl)=NC=NC2=C1.COCCOC1=C(OCCOC)C=C2C(NC3=CC(=CC=C3)C#C)=NC=NC2=C1 erlotinib-ros-090309 [H][C@]12[C@@H](C)C(S[C@@H]3CN[C@@H](C3)C(=O)NC3=CC=CC(=C3)C(=O)O[Na])=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O ertapenem-sodium COC1=CC2=C(NC(=N2)S(=O)CC2=C(C)C(OC)=C(C)C=N2)C=C1 esomeprazole-api COC1=CC2=C(C=C1)N([K])C(=N2)S(=O)CC1=C(C)C(OC)=C(C)C=N1 esomeprazole-potassium COC1=CC2=C(NC(=N2)N2C=C(C)C(=O)C(C)=C2C(O)=O)C=C1 esomeprazole-pyridone-acid COC1=CC2=C(C=C1)N([Na])C(=N2)S(=O)CC1=C(C)C(OC)=C(C)C=N1 esomeprazole-sodium C[C@]12CCC3C(CCC4=CC(O)=CC=C34)C1CC=C2 estratetraenol COC1=CC=C2C3CC[C@]4(C)C=CCC4C3CCC2=C1 estratetraenol-methyl-ether C[C@]12CCC3=C(CCC4=CC(O)=CC=C34)C1CCC2=O estratetraenone COC1=CC=C2C(CCC3=C2CC[C@@]2(C)C3CCC2=O)=C1 estratetraenone-methyl-ether CCOS(=O)(=O)C1=CC=CC=C1 ethyl-benzenesulfonate [H][C@@]1(C[C@@H](C)[C@]2([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@]3([H])CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O2)OC)CC[C@@H](OCCO)[C@@H](C1)OC everolimus CO[C@@H]1CC(C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1OCCO everolimus-api [V].I.[V]I.II.I[I]I.OCCO.CC(C)(C)[Si](C)(C)Cl.CC(C)(C)[Si](C)(C)OCCO.FC(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F.CC(C)(C)[Si](C)(C)OCCOS(=O)(=O)C(F)(F)F everolimus-intermediate OCCO.CC(C)(C)[Si](C)(C)Cl>>CC(C)(C)[Si](C)(C)OCCO everolimus-intermediate-1 CC(C)(C)[Si](C)(C)OCCO.FC(F)(F)S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CC(C)(C)[Si](C)(C)OCCOS(=O)(=O)C(F)(F)F everolimus-intermediate-2 [H][C@@]1(C[C@@H](C)[C@]2([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@]3([H])CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O2)OC)CC[C@@H](OCCO)[C@@H](C1)OC everolimus-str [V].[H].CC(C)(C)[Si](C)(C)OCCOS(=O)(=O)C(F)(F)F.CO[C@@H]1C[C@@]([H])(CC[C@H]1O)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1.CO[C@@H]1C[C@@]([H])(CC[C@H]1OCCO[Si](C)(C)C(C)(C)C)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1 everolimus-syn-scheme [H][C@]12SC([C@@H]3CCCO3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O faropenem-acid [H][C@]12SC([C@@H]3CCCO3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(=O)O[Na] faropenem-sodium CC(C)COC1=CC=C(C=C1C#N)C1=NC(C)=C(S1)C(O)=O febuxostat CCOC(=O)C1=C(C)N=C(S1)C1=CC=C(OCC(C)C)C(=C1)C#N febuxostat-et OC(=O)C1=CC=CC=C1C(=O)C1=CC(=C(O)C=C1)C1=CC=CC=C1 fendizoic-acid C[C@@H]1O[C@@H]1P(O)(O)=O.NC(CO)(CO)CO fosfomycin-tromethamine CCC(=O)OC(OP(=O)(CCCCC1=CC=CC=C1)CC(=O)N1C[C@@H](C[C@H]1C(O)=O)C1CCCCC1)C(C)C fosinopril-acid CCC(=O)OC(OP(=O)(CCCCC1CCCCC1)CC(=O)N1C[C@@H](C[C@H]1C(O)=O)C1CCCCC1)C(C)C fosinopril-cyclohexyl OC(=O)[C@@H]1C[C@H](CN1C(=O)CP(O)(=O)CCCCC1=CC=CC=C1)C1CCCCC1 fosinopril-diacid CCC(=O)OC(OP(=O)(CCCCC1=CC=CC=C1)CC(=O)N1C[C@@H](C[C@H]1C(=O)O[Na])C1CCCCC1)C(C)C fosinopril-sodium O[C@@H]1CC[C@@]2(C)[C@@]([H])(CC[C@@]3(C)[C@@]2([H])[C@H](O)C[C@@]2([H])\C([C@@H](OC(=O)C)C[C@]32C)=C(/CCC=C(C)C)C(=O)O)[C@@H]1C fusidic-acid [Na]OC(=O)C(\CCC=C(C)C)=C1/[C@@H](OC(=O)C)C[C@@]2(C)[C@@]1([H])C[C@@H](O)[C@@]1([H])[C@@]3(C)CC[C@@H](O)[C@@H](C)[C@]3([H])CC[C@]21C fusidic-sodium I.[V]I.II.I[I]I.NC1=CC(Cl)=C(F)C=C1.COC1=C(OC(C)=O)C=C2C(=O)NC=NC2=C1.COC1=C(OC(C)=O)C=C2C(Cl)=NC=NC2=C1.COC1=C(O)C=C2C(NC3=CC(Cl)=C(F)C=C3)=NC=NC2=C1.COC1=C(OCCCN2CCOCC2)C=C2C(NC3=CC(Cl)=C(F)C=C3)=NC=NC2=C1 gefitinib-ros-090309 Cl.NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](CO)C(O)C1(F)F gemcitabine-hcl CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)N[C@H]2CC[C@H](C)CC2)C1=O glimepiride-api CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)N[C@@H]2CC[C@H](C)CC2)C1=O glimepiride-cis CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(N)(=O)=O)C1=O glimepiride-g1 CCC1=C(C)CNC1=O.O=C=NCCC1=CC=CC=C1.CCC1=C(C)CN(C(=O)NCCC2=CC=CC=C2)C1=O.CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(N)(=O)=O)C1=O glimepiride-g1-syn-scheme C[C@H]1CC[C@@H](CC1)N=C=O glimepiride-g2 [H+].C[C@H]1CC[C@@H](CC1)N=C=O.CC1CCC(CC1)C(O)=O.C[C@H]1CC[C@@H](CC1)C(O)=O.CC1=CC=C(C=C1)C(O)=O glimepiride-g2-syn-scheme CCC1=C(C)CN(C(=O)NCCC2=C(C=CC=C2)S(=O)(=O)NC(=O)N[C@H]2CC[C@H](C)CC2)C1=O glimepiride-ortho CC.CS(N)(=O)=O.ONS(=O)(=O)C=N.C[C@H]1CC[C@H](C)CC1.CCC1=C(C)CNC1=O.C[C@H]1CC[C@@H](CC1)N=C=O.O=C=NCCC1=CC=CC=C1.CCC1=C(C)CN(C(=O)NCCC2=CC=CC=C2)C1=O.CCC1=C(C)CN(C(=O)NCCC2=CC=CC=C2)C1=O.CCC1=C(C)CN(C(=O)NCCC2=CC=CC=C2)C1=O glimepiride-syn-scheme CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)OC)C1=O glimepiride-usp-rc-c CCC1=C(C)CN(C(=O)NCCC2=CC(=CC=C2)S(=O)(=O)NC(=O)NC2CCC(C)CC2)C1=O glimepiride-usp-rc-d CC1=CN=C(C=N1)C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC1CCCCC1 glipizide-api CC1=CN=C(C=N1)C(=O)NCCC1=CC=C(C=C1)S(N)(=O)=O glipizide-ep-imp-a NC1CCCCC1 glipizide-ep-imp-b NS(=O)(=O)C1=CC=C(CCNC(=O)C2=NC=CN=C2)C=C1 glipizide-ep-imp-c NC1[C@H](O)OC(CO)[C@@H](O)C1O glucosamine NNC1=NN=CC2=CC=CC=C12 hydralazine-api ClC1=NN=CC2=CC=CC=C12 hydralazine-cl OC1=NN=CC2=CC=CC=C12 hydralazine-oh C1=NN=C2N1N=CC1=CC=CC=C21 hydralazine-triazolo CC1=NN=C2N1N=CC1=CC=CC=C21 hydralazine-triazolo-me CC(C)CC1=CC=C(C=C1)C(C)C(O)=O ibuprofen-acid CC(C)CC1=CC=C(C=C1)C(C)C(O)=O ibuprofen-api CC(C)CC1=CC(=CC=C1)C(C)C(O)=O ibuprofen-ep-imp-a CCCCC1=CC=C(C=C1)C(C)C(O)=O ibuprofen-ep-imp-b CC(C)CC1=CC=C(C=C1)C(C)C(N)=O ibuprofen-ep-imp-c CC(C(O)=O)C1=CC=C(C)C=C1 ibuprofen-ep-imp-d CC(C)CC1=CC=C(C=C1)C(C)=O ibuprofen-ep-imp-e CC(C)CC1=CC=C(CCC(O)=O)C=C1 ibuprofen-ep-imp-f CC(C)CC1=CC=C(C=C1)C(C)C(=O)O[Na] ibuprofen-sodium ClC1=NC=CC(=N1)C1=CC=CN=C1.I>>CC1=C(NC2=NC=CC(=N2)C2=CC=CN=C2)C=C(Cl)C=C1.II.CC1=C(N)C=C(Cl)C=C1 imatinib-ros-090309 O.N=CNCCSC1=C(C(=O)O)N2C(=O)[C@]([H])([C@@H](C)O)[C@@]2([H])C1.[Na]OC(=O)C(=C\CCCCSC[C@@H](N)C(=O)O)\NC(=O)[C@H]1CC1(C)C imipenem-cilastatin-sodium O.[H][C@]12CC(SCCNC=N)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(O)=O imipenem-monohydrate CCCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 irbesartan-api BrCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 irbesartan-bromo CCCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C#N irbesartan-cyano [2H]C([2H])([2H])CCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 irbesartan-d3 CCCCC(=O)NC1(CCCC1)C(=O)NCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 irbesartan-imp-a Cl.CCCCC1=NC2(CCCC2)C(=O)N1 irbesartan-lactam CCCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 irbesartan-n1-trityl CCCCC(=O)NC1(CCCC1)C(=O)NCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 irbesartan-sr49498 CCCCC(=O)NC1(CCCC1)C(=O)NCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 irbesartan-usp-rc-a CCC1=C2C(O)N3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=C1C=C(OC(=O)N1CCC(CC1)N1CCCCC1)C=C2 irinotecan-12-hydroxy CCC1=C2CN3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=C1C=C(OC(=O)N1CCC(CC1O)N1CCCCC1)C=C2 irinotecan-2-hydroxy CCC1=C2CN3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=C1C=C(OC(=O)N1CCC(CC1)N1CCCCC1)C=C2 irinotecan-base CCC1=C2CN3C(=CC4=C(COC4(O)CC)C3=O)C2=NC2=C1C=C(OC(=O)N1CCC(CC1)N1CCCCC1)C=C2 irinotecan-descarbonyl O.O.O.Cl.CCC1=C2CN3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=C1C=C(OC(=O)N1CCC(CC1)N1CCCCC1)C=C2 irinotecan-hcl CCC(=O)C1=C(C)C(=O)N2CC3=C(CC)C4=C(C=CC(OC(=O)N5CCC(CC5)N5CCCCC5)=C4)N=C3C2=C1 irinotecan-keto CCC1OC(=O)C2=C1C=C1N(CC3=C(CC)C4=C(C=CC(OC(=O)N5CCC(CC5)N5CCCCC5)=C4)N=C13)C2=O irinotecan-lactone CCC1=C2CN3C(=CC(=C(CO)C3=O)[C@@](O)(CC)C(=O)O[Na])C2=NC2=C1C=C(OC(=O)N1CCC(CC1)N1CCCCC1)C=C2 irinotecan-sodium CC(C)OS(=O)(=O)C1=CC=CC=C1 isopropyl-benzenesulfonate CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1 itraconazole-api CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC)C=C1 itraconazole-ep-imp-a CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NN=C3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1 itraconazole-ep-imp-b CCCN1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1 itraconazole-ep-imp-c CC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1 itraconazole-ep-imp-d CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OCC2CO[C@@](CN3C=NC=N3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1 itraconazole-ep-imp-e CCCCN1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=C(Cl)C=C(Cl)C=C2)C=C1 itraconazole-ep-imp-f ClC1=CC(Cl)=C(C=C1)[C@@]1(CN2C=NC=N2)OC[C@H](COC2=CC=C(C=C2)N2CCN(CC2)C2=CC=C(C=C2)N2C=NN(C[C@H]3CO[C@@](CN4C=NC=N4)(O3)C3=C(Cl)C=C(Cl)C=C3)C2=O)O1 itraconazole-ep-imp-g C[C@H]1CCC[C@@]2(C)O[C@@]2([H])C[C@]([H])(NC(=O)C[C@H](O)C(C)(C)C(=O)[C@H](C)[C@H]1O)C(\C)=C\C1=CSC(C)=N1 ixabepilone OC1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-1-OH O=C(C1=CC=C2N1CCC2=O)C1=CC=CC=C1 ketorolac-1-keto OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=C(O)C=C1 ketorolac-4-OH [V].I.[V]I.II.I[I]I.OC(=O)C1=CC=C(O)C=C1.CC(=O)OC1=CC=C(C=C1)C(O)=O.CC(=O)OC1=CC=C(C=C1)C(Cl)=O.CC(C)OC(=O)C1CCN2C=CC=C12.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=C(O)C=C1.CC(C)OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=C(OC(C)=O)C=C1 ketorolac-4-OH-syn-scheme OC(=O)C1CCN2C=C(C=C12)C(=O)C1=CC=CC=C1 ketorolac-6-bz OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-acid OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-api O=C(C1=CC=CN1CCC#N)C1=CC=CC=C1 ketorolac-cyano O=C(C1=CC=C2CCCN12)C1=CC=CC=C1 ketorolac-dc COC1(CCN2C(=CC=C12)C(=O)C1=CC=CC=C1)C(O)=O ketorolac-ep-imp-d OCC(CO)(CO)NC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-ep-imp-e OC(=O)C1CCN2C=CC(C(=O)C3=CC=CC=C3)=C12 ketorolac-ep-imp-f COC(=O)C1(O)CCN2C(=CC=C12)C(=O)C1=CC=CC=C1 ketorolac-ep-imp-g CCOC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-et N=C1CCN2C(=CC=C12)C(=O)C1=CC=CC=C1 ketorolac-imino COC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-me NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 ketorolac-tromethamine OCC1=CC(=O)C(O)=CO1 kojic-acid CCCCCCCCCCCCCCCC(=O)OCC1=CC(=O)C(OC(=O)CCCCCCCCCCCCCCC)=CO1 kojic-acid-dipalmitate CC1=C(CS(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole Cl.CC1=C(CCl)N=CC=C1OCC(F)(F)F lansoprazole-LSP08 CC1=C(C)C(=CC=N1)[N](O)=O>>O lansoprazole-LSP09 CC1=C(CS(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole-api CC1=C(CS(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F>>O lansoprazole-ep-imp-a O.CC1=C(CS(=C)(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole-ep-imp-b CC1=C(CSC2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole-ep-imp-c OC1=NC2=C(N1)C=CC=C2 lansoprazole-ep-imp-d SC1=NC2=C(N1)C=CC=C2 lansoprazole-ep-imp-e CC1=C(CS(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1Cl lansoprazole-ep-imp-f CC1=C(CS(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F>>O lansoprazole-n-oxide [Na].CC1=C(CS(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole-sodium CC1=C(CSC2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole-sulfide O.CC1=C(CS(=C)(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F lansoprazole-sulfone CC1=C(CSC2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F>>O lansoprazole-sulphide-n-oxide CC1=C(CS(=C)(=O)C2=NC3=C(N2)C=CC=C3)N=CC=C1OCC(F)(F)F.O>>O lansoprazole-sulphone-n-oxide CC1=C(C=NO1)C(=O)NC1=CC=C(C=C1)C(F)(F)F leflunomide C\C(O)=C(\C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F leflunomide-metabolite CC[C@H](N1CCCC1=O)C(N)=O levetiracetam-api CCC(N1CCCC1=O)C(O)=O levetiracetam-imp-a C\C=C(\N1CCCC1=O)C(N)=O levetiracetam-imp-b OC1=NC=CC=C1 levetiracetam-imp-c CC[C@@H](N1CCCC1=O)C(N)=O levetiracetam-imp-d ClC1=CC=C(C=C1)C(OCCN1CCCCC1)C1=CC=CC=C1 levocloperastine-base ClC1=CC=C(C=C1)C(OCCN1CCCCC1)C1=CC=CC=C1.OC(=O)C1=CC=CC=C1C(=O)C1=CC(=C(O)C=C1)C1=CC=CC=C1 levocloperastine-fendizoate Cl.ClC1=CC=C(C=C1)C(OCCN1CCCCC1)C1=CC=CC=C1 levocloperastine-hcl CC1COC2=C(N3CCN(C)CC3)C(F)=CC3=C2N1C=C(C(O)=O)C3=O levofloxacin-api CC1COC2=C(N3CCN(C)CC3)C(F)=CC3=C2N1C=CC3=O levofloxacin-descarboxy Cl.CNCCNC1=C2OCC(C)N3C=C(C(O)=O)C(=O)C(C=C1F)=C23 levofloxacin-desethylene CC1COC2=C(C=CC3=C2N1C=C(C(O)=O)C3=O)N1CCN(C)CC1 levofloxacin-desfluoro CC1COC2=C(N(CCN(C)C=O)C=O)C(F)=CC3=C2N1C=C(C(O)=O)C3=O levofloxacin-diformyl CC1COC2=C(N3CCNCC3)C(F)=CC3=C2N1C=C(C(O)=O)C3=O levofloxacin-n-desmethyl CCOC(=O)[C@@H](N)CC1=CC(I)=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1 levothyroxine-ethyl-ester COC(=O)[C@@H](N)CC1=CC(I)=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1 levothyroxine-methyl-ester O.N[C@@H](CC1=CC(I)=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1)C(=O)O[Na] levothyroxine-sodium CCCCCC[C@@H]1C(=O)O[C@H]1C[C@H](C\C=C/C\C=C/CCCCC)OC(=O)[C@@H](NC=O)CC(C)C lipstatin O.O.NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O lisinopril O.O.NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O lisinopril-api NCCCCC(NC(CCC1=CC=CC=C1)C(=O)NCCCCC(NC(CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCCC1C(O)=O)C(=O)N1CCCC1C(O)=O lisinopril-dimer NC(CCC1=CC=CC=C1)C(O)=O lisinopril-ep-imp-a CC1=CC=C(C=C1)S(O)(=O)=O lisinopril-ep-imp-b [H][C@@]12CCCN1C(=O)[C@H](CCCCN)N([C@@H](CCC1=CC=CC=C1)C(O)=O)C2=O lisinopril-ep-imp-c [H][C@]12CCCN1C(=O)[C@H](CCCCN)N([C@@H](CCC1=CC=CC=C1)C(O)=O)C2=O lisinopril-ep-imp-d NCCCC[C@H](N[C@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O lisinopril-ep-imp-e NCCCC[C@H](N[C@@H](CCC1CCCCC1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O lisinopril-ep-imp-f CCOC(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC(O)=C3)C=C(Cl)C=C2 loratadine-3-oh CCOC(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-api CCOC(=O)N1CCC(CC1)C1(O)C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-ep-imp-a ClC1=CC2=C(C=C1)C(=O)C1=C(CC2)C=CC=N1 loratadine-ep-imp-b CCOC(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3Cl)C=C(Cl)C=C2 loratadine-ep-imp-c ClC1=CC2=C(C=C1)C(=C1CCNCC1)C1=C(CC2)C=CC=N1 loratadine-ep-imp-d CCOC(=O)N1CCC(=CC1)C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-ep-imp-e CCOC(=O)N1CCC(CC1)C1(F)C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-ep-imp-f CN1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-ep-imp-g CCOC(=O)N1CCC(=O)CC1 loratadine-ep-imp-h CC(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-n-acetyl [H]C(=O)N1CCC(CC1)=C1C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-n-formyl CN1CCC(CC1)C1(O)C2=C(CCC3=C1N=CC=C3)C=C(Cl)C=C2 loratadine-usp-rc-d ClC1=CC2=C(C=C1)C(=O)C1=C(CC2)C(Cl)=CC=N1 loratadine-usp-rc-e CCCCC1=NC(Cl)=C(N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)C(O)=O losartan-acid CCCCC1=NC(Cl)=C(C=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-aldehyde CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-api CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1 losartan-base BrCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 losartan-bromo CCCCC1=NC(Cl)=C(COC(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 losartan-ditrityl CCCCC1=NC(Cl)=C(CO)N1 losartan-ep-imp-a OCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-b CCCCC1=NC(CO)=C(Cl)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-c CCCCC1=NC(Cl)=C(N1)C=O losartan-ep-imp-d CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-e CCCCC1=NC(Cl)=C(COC(C)C)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-f OC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 losartan-ep-imp-g CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 losartan-ep-imp-h CCCCC1=NC(Cl)=C(COC(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-i CCCCC1=NC(Cl)=C(COC(C)=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-j CCCCC1=NC(Cl)=C(C=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-ep-imp-k [K].CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1 losartan-k BrCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 losartan-lst15 CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(O)=O)C12 lovastatin-acid CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3CC=CC(=O)O3)C12 lovastatin-anhydro-lactone CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C\C=C/C(=O)O[Na])C12 lovastatin-anhydro-sodium CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)C12 lovastatin-api CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)CC2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)C12 lovastatin-dihydro CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)C(CC[C@@H](O)C[C@@H](O)CC(=O)O[C@@H]3CC(CC[C@H]4[C@@H](C)C=CC5=C[C@H](C)C[C@H](OC(=O)[C@@H](C)CC)C45)OC(=O)C3)C12 lovastatin-dimer CC[C@@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)C12 lovastatin-epi CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)O[Na])C12 lovastatin-sodium Cl.CC12CC3CC(C)(C1)CC(N)(C3)C2 memantine-hcl CC meropenem-4-aa O.O.O.[H][C@]1([C@@H](C)O)C(=O)N2C(C(O)=O)=C(S[C@@H]3CN[C@@H](C3)C(=O)N(C)C)[C@H](C)[C@]12[H] meropenem-trihydrate CN(CC1=NC2=C(N)N=C(N)N=C2N=C1)C1=CC=C(C=C1)C(=O)NC(CCC(O)=O)C(O)=O methotrexate CN(CC1=NC2=C(N)N=C(N)N=C2N=C1O)C1=CC=C(C=C1)C(=O)NC(CCC(O)=O)C(O)=O methotrexate-7-oh CN(CC1=NC2=C(N)N=C(N)N=C2N=C1)C1=CC=C(C=C1)C(=O)NC(CCC(O)=O)C(O)=O methotrexate-api NC1=NC(N)=C2N=C(CO)C=NC2=N1 methotrexate-ep-imp-a [H]N(CC1=NC2=C(N)N=C(N)N=C2N=C1)C1=CC=C(C=C1)C(=O)NC(CCC(O)=O)C(O)=O methotrexate-ep-imp-b CN(CC1=NC2=C(O)N=C(N)N=C2N=C1)C1=CC=C(C=C1)C(=O)NC(CCC(O)=O)C(O)=O methotrexate-ep-imp-c CN(CC1=NC2=C(O)N=C(N)N=C2N=C1)C1=CC=C(C=C1)C(O)=O methotrexate-ep-imp-d CN(CC1=NC2=C(N)N=C(N)N=C2N=C1)C1=CC=C(C=C1)C(O)=O methotrexate-ep-imp-e COS(=O)(=O)C1=CC=CC=C1 methyl-benzenesulfonate COCCC1=CC=C(OCC(O)CNC(C)C)C=C1 metoprolol-api COCCC1=CC=C(OCC(O)CNC(C)C)C=C1 metoprolol-base COCCC1=CC=C(OCC(O)COC2=CC=C(CCOC)C=C2)C=C1 metoprolol-bmepp COCCC1=CC=C(OCC(O)COCC(O)COC2=CC=C(CCOC)C=C2)C=C1 metoprolol-dimer CCNCC(O)COC1=CC=C(CCOC)C=C1 metoprolol-ep-imp-a COCCC1=CC=C(O)C=C1 metoprolol-ep-imp-b [H]C(=O)C1=CC=C(OCC(O)CNC(C)C)C=C1 metoprolol-ep-imp-c OC(=O)\C=C/C(O)=O.[H]C(=O)C1=CC=C(OCC(O)CNC(C)C)C=C1 metoprolol-ep-imp-c-maleate COCCC1=CC=C(OCC(O)CO)C=C1 metoprolol-ep-imp-d COCCC1=CC=CC=C1OCC(O)CNC(C)C metoprolol-ep-imp-e CC(C)NCC(O)COC1=CC=CC=C1 metoprolol-ep-imp-f Cl.CC(C)NCC(O)COC1=CC=CC=C1 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CCCCCOC1=CC=C(C=C1)C1=CC(=NO1)C1=CC=C(C=C1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(O)(=O)=O)=C1)[C@H](O)CC(N)=O micafungin-acid C[C@@H](O)[C@@H]1NC(=O)[C@@H](N)C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C1=O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O micafungin-intermediate-fr-179642 CCCCCOC1=CC=C(C=C1)C1=CC(=NO1)C1=CC=C(C=C1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O micafungin-sodium C[C@@H](O)[C@@H]1NC(=O)[C@@H](N)C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C1=O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O.CCCCCCCCCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O.CCCCCOC1=CC=C(C=C1)C1=CC(=NO1)C1=CC=C(C=C1)C(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O micafungin-syn-scheme OCCN1CC(O)C(O)C(O)C1CO miglitol I.II.I[I]I.OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O.OCCN1CC(O)C(O)C(O)C1CO.OCCNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.OCCNCC1OC(O)(CO)C(O)C1O miglitol-ros-110903 [H][C@@]12CC3=C(C(O)=CC=C3N(C)C)C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2 minocycline-base Cl.[H][C@@]12CC3=C(C(O)=CC=C3N(C)C)C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2 minocycline-hcl COC1=C(C)C(=O)C2=C([C@@H](COC(N)=O)[C@@]3(OC)[C@H]4N[C@H]4CN23)C1=O mitomycin-a-str COC1=C(C)C(=O)C2=C([C@H](COC(N)=O)[C@@]3(OC)[C@H]4N[C@H]4CN23)C1=O mitomycin-b-str CO[C@]12[C@H]3N[C@H]3CN1C1=C([C@H]2COC(N)=O)C(=O)C(N)=C(C)C1=O mitomycin-c-str CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@H](O)C3=C2COC(N)=O)C1=O mitosene-diamino-hydroxy-cis CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@@H](O)C3=C2COC(N)=O)C1=O mitosene-diamino-hydroxy-trans CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@H](O)[C@]3(O)[C@@H]2COC(N)=O)C1=O mitosene-dihydro-diamino-hydroxy-cis CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@@H](O)[C@]3(O)[C@@H]2COC(N)=O)C1=O mitosene-dihydro-diamino-hydroxy-trans CC1=C(N)C(=O)C2=C(N3CC(N)=CC3=C2CO)C1=O mitosene-rc-259 CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@H](O)C3=C2COC(N)=O)C1=O.CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@@H](O)C3=C2COC(N)=O)C1=O.CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@H](O)[C@]3(O)[C@@H]2COC(N)=O)C1=O.CC1=C(N)C(=O)C2=C(N3C[C@H](N)[C@@H](O)[C@]3(O)[C@@H]2COC(N)=O)C1=O mitosene-rc-pathway NC(=O)C1=C(O)N(C=N1)[C@@H]1O[C@H](CO)C(O)C1O mizoribine-str CC(=O)OC1=CC=CC2=C1C(=O)C1=C(C=C(C=C1O)C(O)=O)C2=O monoacerein O[C@@H](C[C@@H](SCC1(CC1)CC(=O)O)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1)C1=C(C(O)(C)C)C=CC=C1 montelukast-21R-OH O[C@H](C[C@@H](SCC1(CC1)CC(=O)O)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1)C1=C(C(O)(C)C)C=CC=C1 montelukast-21S-OH O[C@@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-3 OC(=O)CC1(CS)CC1 montelukast-4 COC(=O)C1=CC=CC=C1CC[C@H](O)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-5 COC(=O)C1=CC=CC=C1CCC(=O)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-6 O=C(O)CC1(CC1)CS[C@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-acid O=C(O)CC1(CC1)CS[C@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C/C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-cis-1R O=C(O)CC1(CC1)CS[C@@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C/C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-cis-1S O=C(O)CC1(CC1)CS[C@H](CCC1=C(C(=C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-dehydro C1CCC(CC1)NC1CCCCC1.O=C(O)CC1(CC1)CS[C@H](CCC1=C(C=CC=C1)C(O)(C)C)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-dicyclohexylamine CC(C)(O)C1=C(CC[C@@H](SCC2(CC(O)=O)CC2)C2=CC(CCC3=NC4=C(C=CC(Cl)=C4)C=C3)=CC=C2)C=CC=C1 montelukast-dihydro CC(C)(O)C1=C(CC[C@@H](SCC2(CC(=O)O[Na])CC2)C2=CC(CCC3=NC4=C(C=CC(Cl)=C4)C=C3)=CC=C2)C=CC=C1 montelukast-dihydro-sodium OC(=O)CC1(CSSCC2(CC(O)=O)CC2)CC1 montelukast-disulfide CC1(C)OC(CCC2=CC=CC=C12)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-ether OCC(O)(C)C1=C(CC[C@@H](SCC2(CC2)CC(=O)O)C2=CC(\C=C\C3=NC4=C(C=CC(Cl)=C4)C=C3)=CC=C2)C=CC=C1 montelukast-hydroxy ClC1=CC2=C(C=C1)C=CC(\C=C\C1=CC=CC(=C1)C1CCC3=C(C=CC=C3)C(=O)O1)=N2 montelukast-lactone O=C(O)CC1(CC1)CS(=O)[C@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-s-oxide [Na]OC(=O)CC1(CC1)CS[C@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-sodium [Na]OC(=O)CC1(CC1)CS[C@@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-sodium-s-isomer O=C(O)CC1(CC1)CS(=O)(=O)[C@H](CCC1=C(C(O)(C)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-sulfone B.[Na].O=S.[Na]C#N.ClS(Cl)=O.OCC1(CO)CC1.OCC1(CC#N)CC1.COCC1(COC)CC1.OC(=O)CC1(CS)CC1.CCOC(=O)C1(CC1)C(=O)OCC montelukast-syn-scheme-p3 O=C(O)CC1(CC1)CS[C@H](CCC1=C(C(=O)C)C=CC=C1)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-usp-rc-e C1CCC(CC1)NC1CCCCC1.O=C(O)CC1(CC1)CS[C@H](CCC1=C(C=CC=C1)C(=O)C)C1=CC(\C=C\C2=NC3=C(C=CC(Cl)=C3)C=C2)=CC=C1 montelukast-usp-rc-e-dcha [H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(OC)C2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-base [H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(F)C2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-ep-imp-a Cl.[H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(F)C2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-ep-imp-a-hcl [H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(OC)C2=C(C=C1OC)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-ep-imp-b [H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(OCC)C2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-ep-imp-c [H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(F)C2=C(C=C1OC)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-ep-imp-d [H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(O)C2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-ep-imp-e Cl.[H][C@]12CN(C[C@@]1([H])NCCC2)C1=C(OC)C2=C(C=C1F)C(=O)C(=CN2C1CC1)C(O)=O moxifloxacin-hcl CC(O)=O.CCCCCCCCOC(=O)\C=C(/C)C[C@@H]1OCC(C[C@@H]2O[C@H]2[C@@H](C)[C@H](C)O)[C@@H](O)[C@H]1O mupirocin CC(O)=O.CCCCCCCCOC(=O)\C=C(/C)C[C@@H]1OCC(C[C@@H]2O[C@H]2[C@@H](C)[C@H](C)O)[C@@H](O)[C@H]1O mupirocin-acid COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(=O)N(C)C mycophenolate-amide COC1=C(C)C2=C(C(=O)OC2O)C(O)=C1C\C=C(/C)CCC(=O)OCCN1CCOCC1 mycophenolate-api-OH-str COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(=O)OCCN1CCOCC1 mycophenolate-api-str COC1=C(C)C2=C(C(=O)OC2)C(OCCN2CCOCC2)=C1C\C=C(/C)CCC(=O)OCCN1CCOCC1 mycophenolate-di-mofetil-str COC1=C(C\C=C(/C)CCC(=O)OC2=C(C\C=C(/C)CCC(=O)OCCN3CCOCC3)C(OC)=C(C)C3=C2C(=O)OC3)C(O)=C2C(=O)OCC2=C1C mycophenolate-dimer Cl.C\C(CCC(=O)OCCN1CCOCC1)=C/CC1=C(O)C2=C(COC2=O)C(C)=C1O mycophenolate-ep-imp-a-hcl C\C(CCC(=O)OCCN1CCOCC1)=C/CC1=C(O)C2=C(COC2=O)C(C)=C1O mycophenolate-ep-imp-a-str COC1=C(C)C2=C(C(=O)O[C@H]2OCCN2CCOCC2)C(O)=C1C\C=C(/C)CCC(=O)OCCN1CCOCC1 mycophenolate-ep-imp-b COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(\C)CCC(=O)OCCN1CCOCC1 mycophenolate-ep-imp-c COC1=C(C\C=C(/C)CCC(=O)OCCN2CCOCC2)C(OC)=C(C)C2=C1C(=O)OC2 mycophenolate-ep-imp-d-str COC(=O)CC\C(C)=C\CC1=C(O)C2=C(COC2=O)C(C)=C1O mycophenolate-ep-imp-e-dm-str COC(=O)CC\C(C)=C\CC1=C(O)C2=C(COC2=O)C(C)=C1OC mycophenolate-ep-imp-e-str COC1=C(C\C=C(/C)CCC(O)=O)C(OC)=C(C)C2=C1C(=O)OC2 mycophenolate-ep-imp-f-m-str COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(O)=O mycophenolate-ep-imp-f-str COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(=O)OCCN1CCOCC1.O>> mycophenolate-ep-imp-g-str COC1=C(C)C2=C(C(=O)OC2)C2=C1CCC(C)(CCC(=O)OCCN1CCOCC1)O2 mycophenolate-ether CCC.CC1=C2OC(C)(CCC(O)=O)CCC2=C(O)C2=C1COC2=O.COC1=C(C)C2=C(C(=O)OC2)C2=C1CCC(C)(CCC(O)=O)O2.C\C(CCC(=O)OCCN1CCOCC1)=C/CC1=C(O)C2=C(COC2=O)C(C)=C1O.CC1=C2OC(C)(CCC(=O)OCCN3CCOCC3)CCC2=C(O)C2=C1COC2=O.COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(=O)OCCN1CCOCC1.COC1=C(C)C2=C(C(=O)OC2)C2=C1CCC(C)(CCC(=O)OCCN1CCOCC1)O2 mycophenolate-ether-formation CC1=C2OC(C)(CCC(=O)OCCN3CCOCC3)CCC2=C(O)C2=C1COC2=O mycophenolate-ether-o-desmethyl COC1=C(C)C2=C(C(=O)OC2)C(O)=C1C\C=C(/C)CCC(=O)O[Na] mycophenolate-na C\C(CCC(O)=O)=C/CC1=C(O)C2=C(COC2=O)C(C)=C1O mycophenolic-acid-demethyl-str COC1=C(C)C2=C(C(=O)OC2)C2=C1CCC(C)(CCC(O)=O)O2 mycophenolic-ether CC1=C2OC(C)(CCC(O)=O)CCC2=C(O)C2=C1COC2=O mycophenolic-ether-o-desmethyl COC1=C(C)C2=C(C(=O)OC2)C2=C1CC(O2)C1(C)CCC(=O)O1 mycophenolic-lactone-ether-str COC1=C(C)C2=C(C(=O)OC2)C(O)=C1CC(O)C1(C)CCC(=O)O1 mycophenolic-lactone-oh-str COC1=C(C)C2=C(C(=O)OC2)C(O)=C1CCC1(C)CCC(=O)O1 mycophenolic-lactone-str COC(=O)CC\C(C)=C\CC1=C(OC)C2=C(COC2=O)C(C)=C1OC mycophenolic-methyl-methyl-ester-str COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC=C1[N](O)=O)C(=O)OC nifedipine-api [2H]C1=C([2H])C([2H])=C(C(=C1[2H])C1C(C(=O)OC)=C(C)NC(C)=C1C(=O)OC)[N](O)=O nifedipine-d4 COC(=O)C1=C(C2=CC=CC=C2[N](O)=O)C(C(=O)OC)=C(C)N=C1C nifedipine-ep-imp-a COC(=O)C1=C(C2=CC=CC=C2N=O)C(C(=O)OC)=C(C)N=C1C nifedipine-ep-imp-b COC(=O)C(=C/C1=CC=CC=C1[N](O)=O)\C(C)=O nifedipine-ep-imp-c COC(=O)\C=C(/C)N nifedipine-ep-imp-d CSCC1CN(N=CC2=CC=C(O2)[N](O)=O)C(=O)O1 nifuratel-api CCOC(=O)C1=CC=C(O1)[N](O)=O nifuratel-ethyl-ester CN.O[N](=O)C1=CC=C(O1)C=C.O[N](=O)C1=CC=C(O1)C=N nifuratel-rc1 CC(=O)OC(OC(C)=O)C1=CC=C(O1)[N](O)=O nifuratel-rc2 Cl.Cl.Cl.CN(C)CC1=NC(CSCCN)=CS1 nizatidine-amino CN\C(NCCSCC1=CSC(CN(C)C)=N1)=C/[N](O)=O nizatidine-api CN(C)CC1=NC(CCl)=CS1 nizatidine-chloro CN(C)CC1=NC(CCl)=CS1 nizatidine-chloro-intermediate CNCC1=NC(CSCCN\C(NC)=C\[N](O)=O)=CS1 nizatidine-desmethyl CNC(NC)=C[N](O)=O nizatidine-ep-imp-a CN\C(SC)=C\[N](O)=O nizatidine-ep-imp-b CN(C)CC1=NC(CSCCN)=CS1 nizatidine-ep-imp-d-base Cl.Cl.Cl.CN(C)CC1=NC(CSCCN)=CS1 nizatidine-ep-imp-d-hcl CN(C)CC1=NC(CSCCNC(=O)C[N](O)=O)=CS1 nizatidine-ep-imp-e O[N](=O)CC(=O)NCCSCC1=NC(CSCCNC(=O)C[N](O)=O)=CS1 nizatidine-ep-imp-f CN(C)CC1=NC(CSCCNC(NCCSCC2=CSC(CN(C)C)=N2)=C[N](O)=O)=CS1 nizatidine-ep-imp-g CN(C)CC(N)=S nizatidine-ep-imp-h CNC(=O)NCCSCC1=CSC(CN(C)C)=N1 nizatidine-ep-imp-i CN(C)CC1=NC(CO)=CS1 nizatidine-ep-imp-j CNC1=NCCS\C1=N\O nizatidine-ep-imp-k CN\C(NCCSCC1=CSC(CN(C)C)=N1)=C/[N](O)=O>>O nizatidine-n-oxide CN(C)CC1=NC(CSCCN)=CS1.CN\C(SC)=C/[N](O)=O.B=N>>CN\C(NCCSCC1=CSC(CN(C)C)=N1)=C/[N](O)=O nizatidine-ros CN\C(NCCSCC1=CSC(CN(C)C)=N1)=C/[N](O)=O.O>> nizatidine-s-oxide CN\C(NCCSCC1=CSC(CN(C)C)=N1)=C/[N](O)=O nizatidine-str N.Cl.N#N.N=N=N.NCCS.N\N=N\N.N\N=N\N=N.ClCC(=O)CCl.N=N\N=N\N=N.CN(C)CC(N)=S.N\N=N\N=N\N=N.CN\C(SC)=C/[N](O)=O.CN(C)CC1=NC(CO)=CS1.CN(C)CC1=NC(CCl)=CS1.CN(C)CC1=NC(CSCCN)=CS1.CN\C(NCCSCC1=CSC(CN(C)C)=N1)=C/[N](O)=O nizatidine-syn-scheme CN1CCN(CC1)C1=NC2=C(NC3=C1C=C(CO)S3)C=CC=C2 olanzapine-2-hydroxy CC1=CC2=C(NC3=C(C=CC=C3)N=C2N)S1 olanzapine-amine CN1CCN(CC1)C1=NC2=C(NC3=C1C=C(C)S3)C=CC=C2 olanzapine-api [2H]C([2H])([2H])N1CCN(CC1)C1=NC2=C(NC3=C1C=C(C)S3)C=CC=C2 olanzapine-d3 CC1=CC2=C(NC3=C(NC2=O)C=CC=C3)S1 olanzapine-lactam CC1=CC2=C(NC3=C(C=CC=C3)N=C2N2CCNCC2)S1 olanzapine-n-desmethyl CN1CCN(CC1)C1=NC2=C(NC3=C1C=C(C)S3)C=CC=C2>>O olanzapine-n-oxide CC1=CC(C#N)=C(NC2=C(C=CC=C2)[N](O)=O)S1 olanzapine-usp-rc-a COC1=CC2=C(NC(=N2)S(=O)CC2=C(C)C(OC)=C(C)C=N2)C=C1 omeprazole COC1=CC2=C(NC(=N2)S(=O)CC2=C(C)C(O)=C(C)C=N2)C=C1 omeprazole-4-desmethyl COC1=CC2=C(NC(=N2)S(=O)CC2=C(C)C(OC)=C(C)C=N2)C=C1 omeprazole-api COC1=CC2=C(NC(=N2)S(=O)CC2=C(C)C(Cl)=C(C)C=N2)C=C1 omeprazole-cl COC1=CC2=C(NC(S)=N2)C=C1 omeprazole-ep-imp-a COC1=CC2=C(NC(=N2)S(=O)CC2=C(C)C=C(C)C=N2)C=C1 omeprazole-ep-imp-b COC1=CC2=C(NC(SCC3=C(C)C(OC)=C(C)C=N3)=N2)C=C1 omeprazole-ep-imp-c COC1=CC2=C(NC(=N2)S(=O)(=O)CC2=C(C)C(OC)=C(C)C=N2)C=C1 omeprazole-ep-imp-d COC1=CC2=C(C=C1)N1C(=S)C3=C(C)C(=O)C(C)=CN3C1=N2 omeprazole-ep-imp-f COC1=CC2=C(C=C1)N=C1N3C=C(C)C(=O)C(C)=C3C(=S)N21 omeprazole-ep-imp-g COC1=CC2=C(NC(=N2)N2C=C(C)C(=O)C(C)=C2C(O)=O)C=C1 omeprazole-pyridone-acid O.COC1=CC2=C(C=C1)N([Na])C(=N2)S(=O)CC1=C(C)C(OC)=C(C)C=N1 omeprazole-sodium COC1=CC2=C(C=C1)N([Na])C(=N2)S(=O)CC1=C(C)C(OC)=C(C)C=N1 omeprazole-sodium-r-isomer O.COC1=CC2=C(NC(=N2)S(=C)(=O)CC2=C(C)C(OC)=C(C)C=N2)C=C1 omeprazole-sulfone COC1=CC2=C(NC(=N2)S(=C)(=O)CC2=C(C)C(OC)=C(C)C=N2)C=C1.O.O>> omeprazole-sulfone-n-oxide CN1C2=C(C3=C1C=CC=C3)C(=O)C(CN1C=CN=C1C)CC2 ondansetron-base CN1C2=C(C3=C1C=CC(CC1=CC4=C(C=C1)N(C)C1=C4C(=O)C(CN4C=CN=C4C)CC1)=C3)C(=O)C(CN1C=CN=C1C)CC2 ondansetron-ep-imp-b Cl.CN1C2=C(C3=C1C=CC=C3)C(=O)C(CN1C=CN=C1C)CC2 ondansetron-hcl CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O orlistat CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O orlistat-api CC(C)C[C@H](NC=O)C(O)=O orlistat-rc1 CCCC oxytocin Cl.FC1=CC2=C(C=C1)C(=NO2)C1CCNCC1 paliperidone-amine CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCC(O)C2=N1 paliperidone-api CC1=C(CCCl)C(=O)N2CCCC(O)C2=N1 paliperidone-cl CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=C(F)C=C3)C(=O)N2CCCC(O)C2=N1 paliperidone-isomer CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCC(=O)C2=N1 paliperidone-keto CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCC(O)C2=N1.O>> paliperidone-n-oxide COC1=C(OC)C(CS(=O)C2=NC3=C(N2)C=CC(OC(F)F)=C3)=NC=C1 pantoprazole-api Cl.COC1=C(OC)C(CCl)=NC=C1 pantoprazole-cl COC1=C(OC)C(CO)=NC=C1 pantoprazole-hydroxy COC1=C(OC)C(CS(=O)C2=NC3=C(N2)C=CC(OC(F)F)=C3)=NC=C1>>O pantoprazole-n-oxide FC(F)OC1=CC2=C(NC(S)=N2)C=C1 pantoprazole-sh COC1=C(OC)C(CS(=O)C2=NC3=C(C=CC(OC(F)F)=C3)N2[Na])=NC=C1 pantoprazole-sodium COC1=C(OC)C(CSC2=NC3=C(N2)C=CC(OC(F)F)=C3)=NC=C1 pantoprazole-sulfide COC1=C(OC)C(CS(=O)(=O)C2=NC3=C(N2)C=CC(OC(F)F)=C3)=NC=C1 pantoprazole-sulfone COC1=C(OC)C(CS(=O)(=O)C2=NC3=C(N2)C=CC(OC(F)F)=C3)=NC=C1>>O pantoprazole-sulfone-n-oxide COC1=C(OC)C(CS(=O)(=O)C2=NC3=C(N2)C=CC(OC(F)F)=C3)=NC=C1 pantoprazole-sulfone-usp-a [H]N1CC[C@H]([C@H](COC2=CC=C(OC)C(O)=C2)C1)C1=CC=C(F)C=C1 paroxetine-3-hm CC(O)=O.FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-acetate FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-api FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-base Cl.FC1=CC=C(C=C1)[C@@H]1CCNC[C@@H]1COC1=CC=C2OCOC2=C1 paroxetine-cis C(OC1=CC=C2OCOC2=C1)[C@@H]1CNCC[C@H]1C1=CC=CC=C1 paroxetine-desfluoro C(OC1=CC=C2OCOC2=C1)[C@@H]1CN(CC2=CC=CC=C2)CC[C@H]1C1=CC=CC=C1 paroxetine-desfluoro-n-benzyl FC1=CC=C(C=C1)C1CCNCC1COC1=C(CC2=C(OCC3CNCCC3C3=CC=C(F)C=C3)C=C3OCOC3=C2)C=C2OCOC2=C1 paroxetine-dimer CN1CCC(C(COC2=C(CC3=C(OCC4CN(C)CCC4C4=CC=C(F)C=C4)C=C4OCOC4=C3)C=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-dimer-n-methyl FC1=CC=C(C=C1)C1CCNCC1COC1=C(CC2=C(OCC3CNCCC3C3=CC=C(F)C=C3)C=C3OCOC3=C2)C=C2OCOC2=C1 paroxetine-dimer-number CCOC(=O)C1C(CC(=O)N(C)C1=O)C1=CC=C(F)C=C1 paroxetine-dione Cl.COC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-ep-imp-b Cl.FC1=CC=C(C=C1)[C@H]1CCNC[C@@H]1COC1=CC=C2OCOC2=C1 paroxetine-ep-imp-d FC1=CC=C(C=C1)C1CCNCC1COC1=C(CC2=C(OCC3CNCCC3C3=CC=C(F)C=C3)C=C3OCOC3=C2)C=C2OCOC2=C1 paroxetine-ep-imp-f CN1CCC(=CC1)C1=CC=C(F)C=C1 paroxetine-ep-imp-g FC1=CC=C(C=C1)C1=CC=CC(=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-ep-imp-j Cl.CCOC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-ethoxy OC=O.FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-formate Cl.[H]N1CC[C@H]([C@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-hcl-anhydrous [H]N1CC[C@H]([C@H](COC2=CC=C(O)C(OC)=C2)C1)C1=CC=C(F)C=C1 paroxetine-hm O=C(O)\C=C/C(=O)O.FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-maleate Cl.COC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-methoxy FC1=CC=C(C=C1)[C@@H]1CCN(CC2=CC=CC=C2)C[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-n-benzyl CN1CCC(C(CO)C1)C1=CC=C(F)C=C1 paroxetine-nma CN1CC[C@@H]([C@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-1 CN1CC[C@H]([C@@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-1-cis CN1CC[C@H]([C@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-2 CN1CC[C@@H]([C@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-2-cis CN1CC[C@H]([C@@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-3r-4r CN1CC[C@@H]([C@@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-3r-4s CN1CC[C@H]([C@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-3s-4r CN1CC[C@@H]([C@H](CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-3s-4s CN1CC[C@H]([C@H](COS(C)(=O)=O)C1)C1=CC=C(F)C=C1 paroxetine-nma-methylate CN1CCC(C(CO)C1)C1=CC=C(F)C=C1 paroxetine-nma-unresolved CN1CC[C@H]([C@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-nmp CN1CC[C@@H]([C@@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-nmp-1 CN1CC[C@H]([C@@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-nmp-3r-4r CN1CC[C@@H]([C@@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-nmp-3r-4s CN1CC[C@H]([C@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-nmp-3s-4r CN1CC[C@H]([C@@H](COC2=CC=C3OCOC3=C2)C1)C1=CC=C(F)C=C1 paroxetine-nmp-cis FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-phosphate OC1=CC=C2OCOC2=C1 paroxetine-sesamol OC1=C(CC2=C(O)C=C3OCOC3=C2)C=C2OCOC2=C1 paroxetine-sesamol-dimer FC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-sulfate Cl.COC1=CC=C(C=C1)[C@@H]1CCNC[C@H]1COC1=CC=C2OCOC2=C1 paroxetine-usp-rc-a CC(O)=O.C(OC1=CC=C2OCOC2=C1)[C@@H]1CNCC[C@H]1C1=CC=CC=C1 paroxetine-usp-rc-b OC[C@@H]1CNCC[C@H]1C1=CC=C(F)C=C1 paroxol-3s-4r OC[C@@H]1CN(CC2=CC=CC=C2)CC[C@H]1C1=CC=C(F)C=C1 paroxol-3s-4r-n-benzyl Cl.OC[C@@H]1CNCC[C@H]1C1=CC=C(F)C=C1 paroxol-hcl-3s-4r OC[C@H]1O[C@H](CC1O)N1C=NC2=C1N=CNC[C@H]2O pentostatin OC1CCN(CCCN2C3=C(SC4=C2C=C(C=C4)C#N)C=CC=C3)CC1 pericyazine [H][C@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC)C(=O)OCC)[C@@]1([H])CCCC2)C(O)=O perindopril-acid [H][C@]12C[C@]3([H])N(C(=O)[C@H](C)N([C@@H](CCC)C(=O)OC(C)C)C3=O)[C@@]1([H])CCCC2 perindopril-dione-isopropyl-ester [H][C@]12C[C@H](N[C@@]1([H])CCCC2)C(O)=O perindopril-ep-imp-a [H][C@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC)C(O)=O)[C@@]1([H])CCCC2)C(O)=O perindopril-ep-imp-b [H][C@]12C[C@]3([H])N(C(=O)[C@H](C)N([C@@H](CCC)C(O)=O)C3=O)[C@@]1([H])CCCC2 perindopril-ep-imp-c [H][C@]12C[C@@]3([H])N(C(=O)[C@H](C)N([C@@H](CCC)C(O)=O)C3=O)[C@@]1([H])CCCC2 perindopril-ep-imp-d [H][C@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC)C(=O)OC(C)C)[C@@]1([H])CCCC2)C(O)=O perindopril-ep-imp-e [H][C@]12C[C@]3([H])N(C(=O)[C@H](C)N([C@@H](CCC)C(=O)OCC)C3=O)[C@@]1([H])CCCC2 perindopril-ep-imp-f CC(C)(C)N.[H][C@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC)C(=O)OCC)[C@@]1([H])CCCC2)C(O)=O perindopril-t-butylamine CC[C@@H]1\C=C(C)\C[C@H](C)CC(OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]([C@H](C)\C=C\C1=O)C(\C)=C\[C@@H]1CC[C@H](Cl)[C@@H](C1)OC pimecrolimus-anhydro CC[C@@H]1\C=C(C)\C[C@H](C)CC(OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@@H]([C@H](C)[C@@H](O)CC1=O)C(\C)=C\[C@@H]1CC[C@H](Cl)[C@@H](C1)OC pimecrolimus-api CCC1=CN=C(CCOC2=CC=C(Br)C=C2)C=C1 pioglitazone-bromo CCC1=CN=C(CCOC2=CC=C(CC3(O)SC(=O)NC3=O)C=C2)C=C1 pioglitazone-ep-imp-a CCC1=CN=C(CCOC2=CC=C(CC3SC(=O)N(CCC4=NC=C(CC)C=C4)C3=O)C=C2)C=C1 pioglitazone-ep-imp-c CCOC(=O)C(CC1=CC=C(OCCC2=NC=C(CC)C=C2)C=C1)SC(N)=O pioglitazone-ep-imp-d CCOC(=O)CCC1=CC=C(OCCC2=NC=C(CC)C=C2)C=C1 pioglitazone-ep-imp-e CCC1=CN=C(CCOC2=CC=C(C=O)C=C2)C=C1 pioglitazone-epeba CCC1=CN=C(CCOC2=CC=C(CC3SC(=N)NC3=O)C=C2)C=C1 pioglitazone-epebi CCC1=CN=C(CCOC2=CC=C(\C=C3/SC(=O)NC3=O)C=C2)C=C1 pioglitazone-epebt FC1=CC=C(CC2SC(=O)NC2=O)C=C1 pioglitazone-fluoro Cl.CCC1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 pioglitazone-hcl OC1=CC=C(CC2SC(=O)NC2=O)C=C1 pioglitazone-m1 CCC1=CN=C(C=C1)C(O)COC1=CC=C(CC2SC(=O)NC2=O)C=C1 pioglitazone-m2 CC(=O)C1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 pioglitazone-m3 CC(O)C1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 pioglitazone-m4 OC(=O)CC1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 pioglitazone-m5 CCC1=CN=C(CCOC2=CC=C(CC(C(N)=O)S(O)(=O)=O)C=C2)C=C1 pioglitazone-sulfonic Cl.[V].I.[V]I.[V]I.II.I[I]I.NC(N)=S.O[N](=O)C1=CC=C(F)C=C1.CCC1=CN=C(CCO)C=C1.CCC1=CN=C(CCOC2=CC=C(N)C=C2)C=C1.CCC1=CN=C(CCOC2=CC=C(C=C2)[N](O)=O)C=C1.CCC1=CN=C(CCOC2=CC=C(CC(Br)C(=O)OC)C=C2)C=C1.CCC1=CN=C(CCOC2=CC=C(CC3SC(=N)NC3=O)C=C2)C=C1.CCC1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1 pioglitazone-syn-scheme-1 O[C@H](\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1)CC(=O)CC(O)=O pitavastatin-3-oxo-acid CCOC(=O)CC(=O)C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-3-oxo-ethyl-ester O[C@@H](CC(O)=O)CC(=O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-5-oxo-acid CCOC(=O)C[C@H](O)CC(=O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-5-oxo-ethyl-ester O=C(C[C@H]1C[C@@H](\C=C\C2=C(C3=CC=C(F)C=C3)C3=CC=CC=C3N=C2C2CC2)OC(C)(C)O1)OC(C)(C)C pitavastatin-acetonide-t-butyl-ester O[C@H](C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1)CC(O)=O pitavastatin-acid CCOC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-ethyl-ester O[C@@H]1CC(\C=C\C2=C(C3=CC=C(F)C=C3)C3=CC=CC=C3N=C2C2CC2)OC(=O)C1 pitavastatin-lactone COC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-methyl-ester [Na]OC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-sodium [Na]OC(=O)CC(=O)C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-sodium-3-oxo [Na]OC(=O)C[C@H](O)CC(=O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1 pitavastatin-sodium-5-oxo O[C@H](C[C@H](O)\C=C\C1=C(C2=CC=C(F)C=C2)C2=CC=CC=C2N=C1C1CC1)CC(=O)OC(C)(C)C pitavastatin-t-butyl-ester CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)C(C)CN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C=C1)[C@H](O)CC(N)=O pneumocandin-a0 CCC(C)CC(C)CCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)CCN2C(=O)C(NC(=O)C(NC(=O)C2C[C@@H](O)CN2C(=O)C(NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C=C1)[C@H](O)CC(N)=O pneumocandin-b0 [H][C@]12[C@H](CC=CC1=C[C@@H](O)[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(O)=O)OC(=O)[C@@H](C)CC pravastatin-3-oh [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(O)=O)OC(=O)[C@@H](C)CC pravastatin-acid [H][C@]12[C@H](C[C@@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(=O)O[Na])OC(=O)[C@@H](C)CC pravastatin-acid-6-epi [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(O)=O)OC(=O)[C@@H](C)CCC pravastatin-acid-me [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(O)=O)OC(=O)[C@@H](C)[C@@H](C)O pravastatin-acid-oh [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C\C=C/C(O)=O)OC(=O)[C@@H](C)CC pravastatin-anhydro-acid [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC1CC=CC(=O)O1)OC(=O)[C@@H](C)CC pravastatin-anhydro-lactone [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C\C=C/C(O)=O)OC(=O)[C@@H](C)CC pravastatin-anhydro-sodium [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC1C[C@@H](O)CC(=O)O1)OC(=O)[C@@H](C)CC pravastatin-lactone [H][C@]12[C@H](C[C@H](O)C=C1C=C[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(=O)O[Na])OC(=O)[C@@H](C)CC pravastatin-sodium [H][C@]12[C@H](CC=CC1=C[C@H](O)[C@H](C)[C@@H]2CCC(O)C[C@@H](O)CC(O)=O)OC(=O)[C@@H](C)CC pravastatin-usp-rc-a [H][C@@]12CCCN1C(=O)[C@@H](CC)NC(=O)[C@@H](NC(=O)C1=NC=CC=C1O)[C@@H](C)OC(=O)[C@@H](NC(=O)[C@]1([H])CC(=O)CCN1C(=O)[C@H](CC1=CC=C(C=C1)N(C)C)N(C)C2=O)C1=CC=CC=C1 pristinamycin-1a [H][C@@]12CCCN1C(=O)[C@@H](CC)NC(=O)[C@@H](NC(=O)C1=NC=CC=C1O)[C@@H](C)OC(=O)[C@@H](NC(=O)[C@]1([H])CC(=O)CCN1C(=O)[C@H](CC1=CC=C(C=C1)N(C)C)N(C)C2=O)C1=CC=CC=C1 pristinamycin-1a-api [H][C@@]12CCCN1C(=O)[C@@H](CC)NC(=O)[C@@H](NC(=O)C1=NC=CC=C1O)[C@@H](C)OC(=O)[C@@H](NC(=O)[C@]1([H])CC(=O)CCN1C(=O)[C@H](CC1=CC=C(NC)C=C1)N(C)C2=O)C1=CC=CC=C1 pristinamycin-1b-api CC(C)[C@H]1OC(=O)C2=CCCN2C(=O)C2=COC(=N2)CC(=O)C[C@H](O)\C=C(/C)\C=C\CNC(=O)\C=C\[C@H]1C pristinamycin-2a-api CC(C)[C@H]1OC(=O)[C@H]2CCCN2C(=O)C2=COC(=N2)CC(=O)C[C@H](O)\C=C(/C)\C=C\CNC(=O)\C=C\[C@H]1C pristinamycin-2b-api CC(CN1C2=C(SC3=C1C=CC=C3)C=CC=C2)N(C)C promethazine-base Cl.CC(CN1C2=C(SC3=C1C=CC=C3)C=CC=C2)N(C)C promethazine-hcl CC(CN1C2=C(C=CC=C2)S(=O)C2=C1C=CC=C2)N(C)C promethazine-sulfoxide CCCOC(C(=O)OC1CCN(C)CC1)(C1=CC=CC=C1)C1=CC=CC=C1 propiverine-base CCCOC(C(=O)OC1CCNCC1)(C1=CC=CC=C1)C1=CC=CC=C1 propiverine-demethyl Cl.CCCOC(C(=O)OC1CCN(C)CC1)(C1=CC=CC=C1)C1=CC=CC=C1 propiverine-hcl CCCOC(C(=O)OC1CCN(C)CC1)(C1=CC=CC=C1)C1=CC=CC=C1>>O propiverine-n-oxide CN1CCC(CC1)OC(=O)C(Cl)(C1=CC=CC=C1)C1=CC=CC=C1 propiverine-rc1 CN1CCC(CC1)OC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1 propiverine-rc2 CNCCCC1C2=C(C=CC=C2)C=CC2=C1C=CC=C2 protriptyline CNCCCC1C2=C(C=CC=C2)C=C(O)C2=C1C=CC=C2 protriptyline-10-oh CNCCCC1C2=C(C=CC=C2)C=CC2=C1C=CC=C2 protriptyline-api OCCOCCN1CCN(CC1)C1=NC2=CC=C(O)C=C2SC2=C1C=CC=C2 quetiapine-7-oh OCCOCCN1CCN(CC1)C1=NC2=CC=CC=C2SC2=C1C=CC=C2 quetiapine-base O=C1NC2=CC=CC=C2SC2=C1C=CC=C2 quetiapine-dbto Cl.Cl.C1CN(CCN1)C1=NC2=CC=CC=C2SC2=C1C=CC=C2 quetiapine-dbtp Cl.Cl.OC1=CC=C2N=C(N3CCNCC3)C3=C(SC2=C1)C=CC=C3 quetiapine-dbtp-7-oh Cl.Cl.C1CN(CCN1)C1=NC2=CC=CC=C2SC2=C1C=CC=C2 quetiapine-dbtp-hcl OCCN1CCN(CC1)C1=NC2=CC=CC=C2SC2=C1C=CC=C2 quetiapine-dbtphe 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COCCCOC1=CC=NC(CS(=O)C2=NC3=C(N2)C=CC=C3)=C1C.O>> rabeprazole-n-oxide CC1=CN(C2=NC3=C(N2)C=CC=C3)C(C(O)=O)=C(C)C1=O rabeprazole-pyridone-acid [Na].COCCCOC1=CC=NC(CS(=O)C2=NC3=C(N2)C=CC=C3)=C1C rabeprazole-sodium COCCCOC1=CC=NC(CSC2=NC3=C(N2)C=CC=C3)=C1C rabeprazole-sulfide COCCCOC1=CC=NC(CS(=O)(=O)C2=NC3=C(N2)C=CC=C3)=C1C rabeprazole-sulfone-base COCCCOC1=CC=NC(CS(=O)(=O)C2=NC3=C(N2)C=CC=C3)=C1C.O>> rabeprazole-sulfone-n-oxide [H][C@@]12CCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1=CC=CC=C1)C(=O)OCC ramipril-api [H][C@@]12CCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1=CC=CC=C1)C(=O)OCC ramipril-base [H][C@@]12CCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1=CC=CC=C1)C(=O)OC ramipril-ep-imp-a [H][C@@]12CCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1=CC=CC=C1)C(=O)OC(C)C ramipril-ep-imp-b [H][C@@]12CCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1CCCCC1)C(=O)OCC ramipril-ep-imp-c [H][C@@]12CCC[C@]1([H])N1C(C2)C(=O)N([C@@H](CCC2=CC=CC=C2)C(=O)OCC)C(C)C1=O ramipril-ep-imp-d [H][C@@]12CCC[C@]1([H])N([C@@H](C2)C(O)=O)C(=O)[C@H](C)N[C@@H](CCC1=CC=CC=C1)C(O)=O ramipril-ep-imp-e CO[C@@H]1CC(C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O rapamycin-api [H][C@@]1(C[C@@H](C)[C@]2([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@]3([H])CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O2)OC)CC[C@@H](O)[C@@H](C1)OC rapamycin-everolimus-str [H][C@@]1(C[C@@H](C)\C=C/C(=O)[C@H](C)\C=C(/C)[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(/C)[C@H](C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O[Na])OC)CC[C@@H](O)[C@@H](C1)OC rapamycin-seco [H][C@@]1(C[C@@H](C)[C@]2([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@]3([H])CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O2)OC)CC[C@@H](O)[C@@H](C1)OC rapamycin-str COC1C(O)C(O)C(OC1CO)N1C2=C(C3=CC=CC(Cl)=C13)C1=C(C(=O)NC1=O)C1=C2NC2=C1C=CC=C2Cl rebeccamycin OC(=O)C1=CC2=C(C(O)=C1)C(=O)C1=C(C=CC=C1O)C2=O rhein CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CC(O)CCC2=N1 risperidone-7-oh CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCC(O)C2=N1 risperidone-9-oh FC1=CC2=C(C=C1)C(=NO2)C1CCNCC1 risperidone-amine Cl.FC1=CC2=C(C=C1)C(=NO2)C1CCNCC1 risperidone-amine-hcl CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCCC2=N1 risperidone-api Cl.FC1=CC(F)=C(C=C1)C(=O)C1CCNCC1 risperidone-benzoyl-hcl CC1=C(CCCl)C(=O)N2CCCCC2=N1 risperidone-chloro CC1=C(CCN2CCC(CC2)C(=N/O)\C2=C(F)C=C(F)C=C2)C(=O)N2CCCCC2=N1 risperidone-ep-imp-a CC1=C(CCN2CCC(CC2)C(=N\O)\C2=C(F)C=C(F)C=C2)C(=O)N2CCCCC2=N1 risperidone-ep-imp-b CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCC(O)C2=N1 risperidone-ep-imp-c CC1=C(CCN2CCC(CC2)C2=NOC3=C2C=C(F)C=C3)C(=O)N2CCCCC2=N1 risperidone-ep-imp-d CC1CCCC2=NC(C)=C(CCN3CCC(CC3)C3=NOC4=C3C=CC(F)=C4)C(=O)N12 risperidone-ep-imp-e CC1=C(CCOC(=O)N2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCCC2=N1 risperidone-ep-imp-f CC1=C(CCN2CCC(CC2)C(=O)C2=C(F)C=C(F)C=C2)C(=O)N2CCCCC2=N1 risperidone-ep-imp-h CC1=C(CCOC(=O)N2CCC(CC2)C(=O)C2=C(C=C(F)C=C2)N2CCC(CC2)C2=NOC3=C2C=CC(F)=C3)C(=O)N2CCCCC2=N1 risperidone-ep-imp-i Cl.Cl.NC1=CC=CC=N1.CC(=O)C1CCOC1=O.CC1=C(CCCl)C(=O)N2CCCCC2=N1.CC1=C(CCCl)C(=O)N2C=CC=CC2=N1.FC1=CC2=C(C=C1)C(=NO2)C1CCNCC1.FC1=CC(F)=C(C=C1)C(=O)C1CCNCC1 risperidone-intermediate-ros NC1=CC=CC=N1.CC(=O)C1CCOC1=O.CC1=C(CCCl)C(=O)N2CCCCC2=N1.CC1=C(CCCl)C(=O)N2C=CC=CC2=N1 risperidone-intermediate-rsp02-ros Cl.FC1=CC(F)=C(C=C1)C(=O)C1CCNCC1 risperidone-rsp5 [H][C@]1(O)[C@H]2NC(=O)[C@]([H])(N)C3=CC(OC4=CC(=CC(O)=C4C)[C@]([H])(NC2=O)C(=O)N[C@@]2([H])C4=CC(OC5=CC=C(C=C5)[C@@H](OC5CC(N)C(O)C(C)O5)[C@]5([H])NC(=O)[C@]([H])(NC2=O)C2=CC(=C(O)C=C2)C2=C(C=C(O)C=C2OC2OC(CO)C(O)C(O)C2O)[C@H](NC5=O)C(=O)OC)=C(OC2OC(COC5OC(C)C(O)C(O)C5O)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(OC2=CC=C1C=C2)=C4)=C(O)C=C3 ristocetin-a CN(CCOC1=CC=C(CC2SC(=O)NC2=O)C=C1)C1=CC=CC=N1 rosiglitazone CN(CCOC1=CC=C(CC2SC(=O)NC2=O)C=C1)C1=CC=C(O)C=N1 rosiglitazone-5-OH [H]C(=O)C1=CC=C(OCCN(C)C2=CC=CC=N2)C=C1 rosiglitazone-aldehyde CN(CCOC1=CC=C(CC2SC(=O)NC2=O)C=C1)C1=CC=CC=N1 rosiglitazone-base O=C1NC(=O)C(CC2=CC=C(OCCNC3=CC=CC=N3)C=C2)S1 rosiglitazone-desmethyl O=C1CSC(=O)N1 rosiglitazone-dione OC(=O)\C=C/C(O)=O.CN(CCOC1=CC=C(CC2SC(=O)NC2=O)C=C1)C1=CC=CC=N1 rosiglitazone-maleate CN(CCOC1=CC=C(\C=C2\SC(=O)NC2=O)C=C1)C1=CC=CC=N1 rosiglitazone-mpaebt [V].I.[V]I.[V]I.II.I[V]I.I[I]I.I[V](I)I.CNCCO.CS(Cl)(=O)=O.ClC1=NC=CC=C1.CN(CCO)C1=NC=CC=C1.CN(CCOS(C)(=O)=O)C1=NC=CC=C1.OC1=CC=C(\C=C2/SC(=O)NC2=O)C=C1.CN(CCOC1=CC=C(CC2SC(=O)NC2=O)C=C1)C1=NC=CC=C1.CN(CCOC1=CC=C(\C=C2/SC(=O)NC2=O)C=C1)C1=NC=CC=C1 rosiglitazone-ros-czg [Na]OC(=O)CC(=O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-3-oxo-sodium [Na]OC(=O)C[C@H](O)C[C@@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-3r-5r-sodium [Na]OC(=O)C[C@@H](O)C[C@@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-3s-5r-sodium [Na]OC(=O)C[C@@H](O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-3s-5s-sodium CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\C(=O)C[C@@H](O)CC(O)=O)N(C)S(C)(=O)=O rosuvastatin-5-oxo-acid [Na]OC(=O)C[C@H](O)CC(=O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-5-oxo-sodium CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H]1C[C@H](CC(=O)OC(C)(C)C)OC(C)(C)O1)N(C)S(C)(=O)=O rosuvastatin-acetonide-t-butyl-ester CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H](O)C[C@@H](O)CC(O)=O)N(C)S(C)(=O)=O rosuvastatin-acid CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H](O)C\C=C\C(O)=O)N(C)S(C)(=O)=O rosuvastatin-dehydro-acid [Na]OC(=O)\C=C\C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-dehydro-sodium CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\C=C\C=C\C(O)=O)N(C)S(C)(=O)=O rosuvastatin-didehydro-acid CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\C=C\C=C\C(=O)O[Na])N(C)S(C)(=O)=O rosuvastatin-didehydro-sodium CCOC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-ethyl-ester CC(C)OC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-isopropyl-ester CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H]1C[C@@H](O)CC(=O)O1)N(C)S(C)(=O)=O rosuvastatin-lactone COC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-methyl-ester CC(C)C1=NC(=NC(C2=CC=C(F)C=C2)=C1\C=C\[C@@H](O)C[C@@H](O)CC(O)=O)NS(C)(=O)=O rosuvastatin-n-desmethyl-acid [Na]OC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)NS(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-n-desmethyl-sodium [Na]OC(=O)C[C@H](O)C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1 rosuvastatin-sodium O[C@H](C[C@H](O)\C=C\C1=C(N=C(N=C1C(C)C)N(C)S(C)(=O)=O)C1=CC=C(F)C=C1)CC(=O)OC(C)(C)C rosuvastatin-t-butyl-ester OCC(=O)NCCCOC1=CC(CN2CCCCC2)=CC=C1 roxatidine Cl.CC(=O)OCC(=O)NCCCOC1=CC(CN2CCCCC2)=CC=C1 roxatidine-acetate-hcl NCCCOC1=CC(CN2CCCCC2)=CC=C1 roxatidine-amine OCC(=O)NCCCOC1=CC(CN2CCCCC2)=CC=C1 roxatidine-base OC1=CC(CN2CCCCC2)=CC=C1 roxatidine-oh CN[C@H]1CC[C@@H](C2=CC(Cl)=C(Cl)C=C2)C2=CC=CC=C12 sertraline CN[C@H]1CC[C@@H](C2=CC(Cl)=C(Cl)C=C2)C2=CC=CC=C12 sertraline-base N[C@H]1CC[C@@H](C2=CC(Cl)=C(Cl)C=C2)C2=CC=CC=C12 sertraline-desmethyl Cl.CN[C@H]1CC[C@@H](C2=CC(Cl)=C(Cl)C=C2)C2=CC=CC=C12 sertraline-hcl CCOC1=CC=C(C=C1C=O)S(=O)(=O)N1CCN(C)CC1 sildenafil-03 CCCC1=NN(C)C(C(N)=O)=C1N sildenafil-04 Cl.CCCC1=NN(C)C(C(N)=O)=C1N sildenafil-04-hcl CCCC1=NN(C)C2=C1N=C(NC2=O)C1=CC=CC=C1OCC sildenafil-07 CCCC1=NN(C)C2=C1N=C(NC2=O)C1=CC(=CC=C1OCC)S(Cl)(=O)=O sildenafil-08 CCCC1=NN(C)C2=C1N=C(NC2=O)C1=CC(=CC=C1OCC)S(=O)(=O)N1CCN(C)CC1 sildenafil-base CCCC1=NN(C)C(C(N)=O)=C1NC(=O)C1=CC=CC=C1OCC sildenafil-carboxamide CCOC1=CC=CC=C1C(Cl)=O sildenafil-chloro OC(=O)CC(O)(CC(O)=O)C(O)=O.CCCC1=NN(C)C2=C1N=C(NC2=O)C1=CC(=CC=C1OCC)S(=O)(=O)N1CCN(C)CC1 sildenafil-citrate CCCC1=NN(C)C2=C1N=C(NC2=O)C1=CC(=CC=C1OCC)S(=O)(=O)N1CCNCC1 sildenafil-desmethyl CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)C12 simvastatin C[C@@H]1C[C@H](OC(=O)C(C)(C)C=C)C2[C@@H](CCC3C[C@@H](O)CC(=O)O3)[C@@H](C)C=CC2=C1 simvastatin-3-en CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3C[C@H](CC(=O)O3)OC(C)=O)C12 simvastatin-acetate CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(O)=O)C12 simvastatin-acid CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)ON)C12 simvastatin-ammonium CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3CC=CC(=O)O3)C12 simvastatin-anhydro OC=O.CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C\C=C/C)C12 simvastatin-anhydro-acid CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C\C=C/C(=O)O[Na])C12 simvastatin-anhydro-sodium CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)C12 simvastatin-api CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)C(CC[C@@H](O)C[C@@H](O)CC(=O)O[C@@H]3CC(CC[C@H]4[C@@H](C)C=CC5=C[C@H](C)C[C@H](OC(=O)C(C)(C)CC)C45)OC(=O)C3)C12 simvastatin-dimer CCOC=O.CC[C@H](O)CC(O)CC[C@H]1[C@@H](C)C=CC2=C[C@H](C)C[C@H](OC(=O)C(C)(C)CC)C12 simvastatin-ethyl-ester CCO[C@@H]1CC(CC[C@H]2[C@@H](C)C=CC3=C[C@H](C)C[C@H](OC(=O)C(C)(C)CC)C23)OC(=O)C1 simvastatin-ethyl-ether CCC(C)(C)C(=O)O[C@H]1CC(=C)C=C2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)C12 simvastatin-exomethylene CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)OCC(O)CO)C12 simvastatin-glycerol-ester CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)OCC3COC(C)(C)O3)C12>>CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)OCC(O)CO)C12.OCC(O)COC(=O)\C=C/CC(O)CC[C@H]1[C@@H](C)C=CC2=C[C@H](C)C[C@H](OC(=O)C(C)(C)CC)C12.OCC(O)COC(=O)\C=C/C=C/CC[C@H]1[C@@H](C)C=CC2=C[C@H](C)C[C@H](OC(=O)C(C)(C)CC)C12 simvastatin-glycerol-ester-by-products CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)OC)C12 simvastatin-methyl-ester CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC3C[C@H](CC(=O)O3)OC)C12 simvastatin-methyl-ether CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CCC(O)C[C@@H](O)CC(=O)O[Na])C12 simvastatin-sodium [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@H](CC2=CC(=O)CC[C@]12C)SC(C)=O spironolactone [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@H](CC2=CC(=O)CC[C@]12C)SC(C)=O spironolactone-api [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C spironolactone-bp-imp-c CNS(=O)(=O)CC1=CC=C(NN)C=C1 sumatriptan-03-str CNS(=O)(=O)CC1=CC=C(N)C=C1 sumatriptan-04-str COC(CCCN(C)C)OC sumatriptan-05-str COC(CCCCl)OC sumatriptan-06-str CNS(=O)(=O)CC1=CC=C(N)C=C1 sumatriptan-amine CNS(=O)(=O)CC1=CC2=C(NC=C2CCN(C)C)C=C1 sumatriptan-base COC(CCCCl)OC sumatriptan-chloro COC(CCCN(C)C)OC sumatriptan-dimethylamino CNS(=O)(=O)CC1=CC=C(NN)C=C1 sumatriptan-hydrazine OC(=O)CCC(O)=O.CNS(=O)(=O)CC1=CC2=C(NC=C2CCN(C)C)C=C1 sumatriptan-succinate CC1=CC=C(C=C1)S(O)(=O)=O.CCOCC(O)COC1=CC=C(NC(=O)CC[S](C)C)C=C1 suplatast CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)C1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H]([C@H](C[C@H]2C)OC)C(C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]1C)OC tacrolimus-api CCC[C@@H]1\C=C(C)\C[C@H](C)CC(OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)OC([C@H](C)[C@@H](O)CC1=O)C(\C)=C\[C@@H]1CC[C@@H](O)[C@@H](C1)OC tacrolimus-dihydro [H][C@@]12CC(=O)N1[C@@H](C(=O)O[Na])[C@](C)(CN1C=CN=N1)S2(=O)=O tazobactam-sodium CCCC1=NC2=C(C=C(C=C2C)C2=NC3=C(C=CC=C3)N2C)N1CC1=CC=C(C=C1)C1=CC=CC=C1C(N)=O telmisartan-amide CCCC1=NC2=C(C=C(C=C2C)C2=NC3=C(C=CC=C3)N2C)N1CC1=CC=C(C=C1)C1=CC=CC=C1C(O)=O telmisartan-api COC(=O)C1=CC=CC=C1C1=CC=C(CBr)C=C1 telmisartan-bromo CCCC1=NC2=C(C=C(C=C2C)C2=NC3=C(C=CC=C3)N2C)N1CC1=CC=C(C=C1)C1=CC=CC=C1C(=O)OCC telmisartan-ethyl-ester CCCC1=NC2=C(N1)C=C(C=C2C)C1=NC2=C(C=CC=C2)N1C telmisartan-imp-a CCCC1=NC2=C(N1CC1=CC=C(C=C1)C1=C(C=CC=C1)C(=O)OC(C)(C)C)C(C)=CC(=C2)C1=NC2=C(C=CC=C2)N1C telmisartan-imp-b 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[H].CO[C@@H]1C[C@@]([H])(CC[C@H]1O)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1.CO[C@@H]1C[C@@]([H])(CC[C@H]1O[Si](C)(C)C)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O[Si](C)(C)C)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1 temsirolimus-syn-scheme-p1 [H].CO[C@@H]1C[C@@]([H])(CC[C@H]1O)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O[Si](C)(C)C)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1.CO[C@@H]1C[C@@]([H])(CC[C@H]1OC(=O)C1(C)COB(OC1)C1=CC=CC=C1)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O[Si](C)(C)C)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1 temsirolimus-syn-scheme-p2 CO[C@@H]1C[C@@]([H])(CC[C@H]1OC(=O)C1(C)COB(OC1)C1=CC=CC=C1)C[C@@H](C)[C@]1([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]2([H])CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@@]2([H])C(=O)O1>>OCC(C)(CO)C(=O)O[C@@H]1CC[C@@]([H])(C[C@@H](C)[C@]2([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@@H](OC)C[C@]3([H])CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O2)C[C@H]1OC.[H] temsirolimus-syn-scheme-p3 [H][C@@](CCN(C(C)C)C(C)C)(C1=CC=CC=C1)C1=CC(C)=CC=C1O tolterodine-base Br.[H][C@@](CCN(C(C)C)C(C)C)(C1=CC=CC=C1)C1=CC(C)=CC=C1O tolterodine-hbr Br.CC(C)N(CCC(C1=CC=CC=C1)C1=CC(C)=CC=C1O)C(C)C tolterodine-hbr-racemic [H][C@@](CCN(C(C)C)C(C)C)(C1=CC=CC=C1)C1=CC(CO)=CC=C1O tolterodine-hydroxy [H][C@@](CCN(C(C)C)C(C)C)(C1=CC=CC=C1)C1=CC(C)=CC=C1OC tolterodine-methoxy O=C(O)\C=C\C(=O)O.COC1=CC=C(C)C=C1[C@]([H])(CCN(C(C)C)C(C)C)C1=CC=CC=C1 tolterodine-methoxy-fumarate [H][C@@](CCNC(C)C)(C1=CC=CC=C1)C1=CC(C)=CC=C1O tolterodine-mono-des-isopropyl Cl.[H][C@@](CCNC(C)C)(C1=CC=CC=C1)C1=CC(C)=CC=C1O tolterodine-mono-des-isopropyl-hcl OC(C(O)C(O)=O)C(O)=O.[H][C@@](CCN(C(C)C)C(C)C)(C1=CC=CC=C1)C1=CC(C)=CC=C1O tolterodine-tartrate CC(O)=O.CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC(O)=C4CN(C)C)N=C13)C2=O topotecan-acetate CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC(O)=C4CN(C)C)N=C13)C2=O topotecan-base Cl.CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC(O)=C4CN(C)C)N=C13)C2=O topotecan-hcl CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(C=CC(O)=C4CNC)N=C13)C2=O topotecan-n-desmethyl CC[C@@](O)(C(=O)O[Na])C1=C(CO)C(=O)N2CC3=CC4=C(C=CC(O)=C4CN(C)C)N=C3C2=C1 topotecan-sodium COC1=CC(=CC=C1)C1=CCCCC1CN(C)C tramadol-ep-imp-c [H][C@@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC3=CC=CC=C3)C(=O)OCC)[C@@]1([H])CCCC2)C(O)=O trandolapril-api [H][C@@]12C[C@H](N[C@@]1([H])CCCC2)C(O)=O trandolapril-bicyclic-acid [H][C@@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC3=CC=CC=C3)C(O)=O)[C@@]1([H])CCCC2)C(O)=O trandolapril-diacid [H][C@@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC3CCCCC3)C(=O)OCC)[C@@]1([H])CCCC2)C(O)=O trandolapril-ep-imp-c [H][C@@]12C[C@H]3CC(=O)CCN([C@@H](CCC4=CC=CC=C4)C(=O)OCC)[C@@H](C)C(=O)N3[C@@]1([H])CCCC2 trandolapril-ep-imp-d [H][C@@]12C[C@H](N(C(=O)[C@H](C)N[C@@H](CCC3=CC=CC=C3)C(=O)OC)[C@@]1([H])CCCC2)C(O)=O trandolapril-methyl-ester NC(CO)(CO)CO tris OC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 tritylmethanol COC(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 tritylmethyl-ether N[C@H]1C[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O validamine N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O valienamine N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O valiolamine CCCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)[C@H](C(C)C)C(O)=O valsartan-api BrCC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1C(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 valsartan-bromo CCCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)[C@@H](C(C)C)C(O)=O valsartan-usp-rc-a CCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)[C@H](C(C)C)C(O)=O valsartan-usp-rc-b CCCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1)[C@H](C(C)C)C(=O)OCC1=CC=CC=C1 valsartan-usp-rc-c [H][C@](CC(C)C)(NC)C(=O)N[C@@]1([H])C(=O)N[C@@]([H])(CC(N)=O)C(=O)N[C@]2([H])C3=CC(OC4=CC=C(C=C4Cl)[C@@]1([H])O)=C(OC1OC(CO)C(O)C(O)C1OC1CC(C)(N)C(O)C(C)O1)C(OC1=CC=C(C=C1Cl)[C@@]([H])(O)[C@]1([H])NC(=O)[C@]([H])(NC2=O)C2=CC=C(O)C(=C2)C2=C(C=C(O)C=C2O)[C@@]([H])(NC1=O)C(O)=O)=C3 vancomycin [H][C@](CC(C)C)(NC)C(=O)N[C@@]1([H])C(=O)N[C@@]([H])(CC(N)=O)C(=O)N[C@]2([H])C3=CC(OC4=CC=C(C=C4Cl)[C@@]1([H])O)=C(OC1OC(CO)C(O)C(O)C1OC1CC(C)(N)C(O)C(C)O1)C(OC1=CC=C(C=C1Cl)[C@@]([H])(O)[C@]1([H])NC(=O)[C@]([H])(NC2=O)C2=CC=C(O)C(=C2)C2=C(C=C(O)C=C2O)[C@@]([H])(NC1=O)C(O)=O)=C3 vancomycin-base CN[C@H](CC(C)C)C(=O)N[C@@H]1[C@H](O)C2=CC=C(OC3=C(OC4OC(CO)C(O)C(O)C4OC4CC(C)(N)C(O)C(C)O4)C4=CC(=C3)[C@@H](NC(=O)[C@H](CC(N)=O)NC1=O)C(=O)NC1C3=CC=C(O)C(=C3)C3=C(C=C(O)C=C3O)[C@@H](NC(=O)[C@@H](NC1=O)C(O)C1=CC=C(O4)C=C1)C(O)=O)C=C2 vancomycin-didechloro 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Cl.COC1=CC=C(C=C1)C(CN(C)C)C1=CCCCC1 venlafaxine-ep-imp-f Cl.COC1=CC=C(C=C1)C(CN(C)C)C1CCCCC1 venlafaxine-ep-imp-g Cl.COC1=CC=C(CCNCC(C2=CC=C(OC)C=C2)C2(O)CCCCC2)C=C1 venlafaxine-ep-imp-h Cl.COC1=CC=C(C=C1)C(CN(C)C)C1(O)CCCCC1 venlafaxine-hcl COC1=CC=C(C=C1)C(CN(C)C)C1(O)CCCCC1 venlafaxine-hcl-number COC1=CC=C(C=C1)C(CN(C)C)C1(O)CCCCC1 venlafaxine-hcl-str-number CC.CC.CCCC.CCCCC.COC1=CC=C(C=C1)C(CN(C)C)C1(O)CCCCC1 venlafaxine-ms Cl.CNCC(C1=CC=C(OC)C=C1)C1(O)CCCCC1 venlafaxine-n-desmethyl Cl.CN(C)CC(C1=CC=C(O)C=C1)C1(O)CCCCC1 venlafaxine-o-desmethyl CC(=O)OC\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C vitamin-a-acetate C\C(=C/CO)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C vitamin-a-str OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O voglibose OCC(CO)N[C@H]1C[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]1O voglibose-api [V].I.[V]I.[V]I.II.I[I]I.OCC1OC(=O)C(O)C(O)C1O.OCC(CO)NC1C[C@](O)(CO)C(O)C(O)C1O.O=C1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1.O[C@]1(COCC2=CC=CC=C2)CC(=O)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1.C(OCC1=CC=CC=C1)C1OC2(OCCO2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1.OCCOC(=C)C(OCC1=CC=CC=C1)C(OCC1=CC=CC=C1)C(OCC1=CC=CC=C1)C(O)COCC1=CC=CC=C1.OCC(CO)NC1C[C@](O)(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1 voglibose-ros-090330 Cl.Cl.OCC(CO)N[C@H]1CC(O)(CO)[C@@H](O)C(O)C1O.OCC(CO)N[C@H]1CC(O)(CO)[C@@H](O)C(O)C1O.OCC(CO)N[C@H]1CC(O)(CCC2=CC=CC=C2)[C@@H](CC2=CC=CC=C2)C(CC2=CC=CC=C2)C1CC1=CC=CC=C1 voglibose-ros-100202 OC1(COC(=O)C2=CC=CC=C2)CC(=O)C(OC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C1OC(=O)C1=CC=CC=C1 voglibose-tbc OC1OC(COC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C(OC(=O)C2=CC=CC=C2)C1OC(=O)C1=CC=CC=C1 voglibose-tbg OCC(CO)N[C@H]1C[C@](O)(COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C1=CC=CC=C1 voglibose-tetrabenzyl Cl.OCC(CO)N[C@H]1C[C@](O)(COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C1=CC=CC=C1 voglibose-tetrabenzyl-hcl C[C@H](C1=C(F)C=NC=N1)[C@@](O)(CN1C=NC=N1)C1=CC=C(F)C=C1F voriconazole-2s-3r C[C@@H](C1=C(F)C=NC=N1)[C@](O)(CN1C=NC=N1)C1=CC=C(F)C=C1F voriconazole-api CC1(C)C2CCC1(CS(O)(=O)=O)C(=O)C2 voriconazole-camphor-sa CC(C1=CC=NC=N1)C(O)(CN1C=NC=N1)C1=CC=C(F)C=C1F voriconazole-desfluoro CCC1=C(F)C=NC=N1 voriconazole-efp FC1=CC=C(C(=O)CN2C=NC=N2)C(F)=C1 voriconazole-keto CCCCCCCCCCCCCCCC(=O)N[C@H]1C[C@@H](O)[C@@H](O)NC(=O)C2[C@@H](O)[C@@H](C)CN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)C2C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)C1=CC=C(O)C(OS(=O)(=O)O[Na])=C1)[C@H](O)CC(N)=O wf11899a CCN(C(C)=O)C1=CC(=CC=C1)C1=CC=NC2=C(C=NN12)C#N zaleplon CCN(C(C)=O)C1=CC(=CC=C1)C(=O)\C=C\N(C)C zaleplon-2 NC1=NNC=C1C#N zaleplon-3 CCN(C(C)=O)C1=CC(=CC=C1)C1=CC=NC2=C(C=NN12)C#N zaleplon-api CC1=CC=C(C=C1)C1=C(CC(O)=O)N2C=C(C)C=CC2=N1 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[H][C@@]1(C[C@@H](C)[C@]2([H])CC(=O)[C@H](C)\C=C(C)\[C@@H](O)C(OC)C(=O)[C@H](C)CC(C)\C=C\C=C\C=C(C)\[C@H](C[C@]3([H])CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@@]3([H])C(=O)O2)OC)CC[C@@H]([C@@H](C1)OC)N1C=NN=N1 zotarolimus-str