Compound | Gericudranin C |
NPACT-Id | NPACT00613 |
IUPAC | 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-6-[(4-hydroxyphenyl)methyl]-2,3-dihydrochromen-4-one |
Synonyms | 6-p-hydroxybenzyltaxifolin |
PubChem Id | 10364206 |
Class | Flavonoid |
In-vitro anticancer activity | 5 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | IZMNVBVTTBCDSK-UHFFFAOYSA-N |
InChi | 1S/C22H18O8/c23-12-4-1-10(2-5-12)7-13-15(25)9-17-18(19(13)27)20(28)21(29)22(30-17)11-3-6-14(24)16(26)8-11/h1-6,8-9,21-27,29H,7H2 |
SMILES | O1[C@H]([C@@H](O)C(=O)c2c1cc(O)c(c2O)Cc1ccc(O)cc1)c1cc(O)c(O)cc1 |
SMART | [H]OC1=C([H])C([H])=C(C([H])=C1[H])C([H])([H])C1=C(O[H])C([H])=C2O[C@@]([H])(C3=C([H])C(O[H])=C(O[H])C([H])=C3[H])[C@@]([H])(O[H])C(=O)C2=C1O[H] |
CAS No. | - |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | C098273 |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | NA, |
Drug-Likeliness Filters | Lipinski's rule of five | No |
Ghose filter | Yes |
Veber filter | No |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |