| Compound | (+)-Gallocatechin |
| NPACT-Id | NPACT00006 |
| IUPAC | (2R,3S)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol |
| Synonyms | Gallocatechin;(+)-Gallocatechin;Gallocatechol;dl-Gallocatechin;(+-)-Gallocatechin;(+-)-Gallocatechol;Gallocatechol,(+-)- |
| PubChem Id | 65084 |
| Class | Flavonoid |
| In-vitro anticancer activity | 3 cancer cell lines |
| In-Vivo anticancer activity | Yes |
| Targets | ALPP | CDC25C | GGT1 | GPT | GSTM1 | TOP2A | All | |
| Properties | Physical Elemental Topological |
| InChi Key | XMOCLSLCDHWDHP-SWLSCSKDSA-N |
| InChi | 1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m0/s1 |
| SMILES | O1[C@@H]([C@@H](O)Cc2c1cc(O)cc2O)c1cc(O)c(O)c(O)c1 |
|
SMART | [H]OC1=C([H])C(O[H])=C2C(O[C@]([H])(C3=C([H])C(O[H])=C(O[H])C(O[H])=C3[H])[C@@]([H])(O[H])C2([H])[H])=C1[H] |
| CAS No. | 970-73-0 |
|
Structure
Download | 
|
| Cross Refrence in other databases |
| Super Natural | - |
| CTD | - |
| HIT | C0439 |
| NCI-60 GI50 data | 970-73-0 |
| Suppliers | ABI Chem, Ambinter, IS Chemical Technology, ZINC, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |