| Compound | 3,3',4',5,6,7,8-heptamethoxyflavone |
| NPACT-Id | NPACT00104 |
| IUPAC | 2-(3,4-dimethoxyphenyl)-3,5,6,7,8-pentamethoxychromen-4-one |
| Synonyms | Hepta-3; 3,5,6,7,8,3',4'-Heptamethoxyflavone |
| PubChem Id | 150893 |
| Class | Flavonoid |
| In-vitro anticancer activity | 10 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | ABCB1 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | SSXJHQZOHUYEGD-UHFFFAOYSA-N |
| InChi | 1S/C22H24O9/c1-24-12-9-8-11(10-13(12)25-2)16-19(27-4)15(23)14-17(26-3)20(28-5)22(30-7)21(29-6)18(14)31-16/h8-10H,1-7H3 |
| SMILES | o1c2c(c(OC)c(OC)c(OC)c2OC)c(=O)c(OC)c1c1cc(OC)c(OC)cc1 |
|
SMART | [H]C1=C([H])C(=C([H])C(OC([H])([H])[H])=C1OC([H])([H])[H])C1=C(OC([H])([H])[H])C(=O)C2=C(O1)C(OC([H])([H])[H])=C(OC([H])([H])[H])C(OC([H])([H])[H])=C2OC([H])([H])[H] |
| CAS No. | 1178-24-1 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C059294 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, |
| Drug-Likeliness Filters | Lipinski's rule of five | Yes |
| Ghose filter | Yes |
| Veber filter | Yes |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |