In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 1st, 2009 | 13 | No |
Popular Name: 2,3-diketogulonate 2,3-diketogulonate
(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate; 2,3-Diketo-L-gulonate; C04575
(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate; 2,3-Dioxo-L-gulonate; 2,3-diketo-L-gulonate; CPD-334
2,3-diketo-L-gulonate; 2,3-dioxo-L-gulonate; 2,3-dioxo-L-gulonate(1-); 2,3-dioxo-L-gulonic
2,3-dioxo-4R,5S,6-trihydroxy-hexanoic acid
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -4.02 | -4.52 | -50.04 | 3 | 7 | -1 | 135 | 191.115 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0007751A1; EP0032830A2; US4159990; US4180511; US4202942; US4212988; US4230880; US4245049; US4337350 | IBM Patent Data |
UniProt Database Links | LYXK_ECOLI; SGBE_ECOLI; SGBH_ECOLI; SGBU_ECOLI; YIAJ_ECOLI; YIAM_ECOLI; YIAN_ECOLI; YIAO_ECOLI | ChEBI |