In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 21 | No |
Popular Name: cyanidin cyanidin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 528-58-5 , [528-58-5]
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxychromenylium chloride
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) | -0.75 | -3.13 | -37.6 | 5 | 6 | 1 | 112 | 287.247 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.75 | -2.34 | -33.22 | 4 | 6 | 0 | 115 | 286.239 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.75 | -2.34 | -39.12 | 4 | 6 | 0 | 115 | 286.239 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
UniProt Database Links | 3AT1_ARATH; 3AT2_ARATH; 3MAT_DAHPI; 5GT_GENTR; 5MAT_ARATH; AA5GT_DIACA; AA7GT_DELGR; AB1C_ARATH; AB2C_ARATH; FAOMT_VITVI; I7GT1_SOYBN; IH5GT_IRIHO; UFOG1_FRAAN; UFOG_VITVI; UGAT_BELPE; UGFGT_MEDTR | ChEBI |
Patent Database Links | EP1325748; EP1514540; EP1602652; EP1681297; EP1683805; EP1787624; EP1808169; EP1882473; US2001002407; US2007189997; US2007191330; US2007248700; WO2005007088; WO2007109600; WO2007125562 | ChEBI |
Target | Vascular endothelial growth factor receptor 1(P17948)&Vascular endothelial growth factor receptor 2(P35968)&Transcription factor AP-1(P05412)&Baculoviral IAP repeat-containing protein 2(Q13490)&Apoptosis regulator Bcl-2(P10415)&Bcl-2-like protein 1(Q07817 | Herbal Ingredients Targets |