Compound | Daidzein |
NPACT-Id | NPACT00476 |
IUPAC | 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one |
Synonyms | 4',7-Dihydroxyisoflavone;7,4'-Dihydroxyisoflavone;Isoaurostatin |
PubChem Id | 5281708 |
Class | Flavonoid |
In-vitro anticancer activity | 16 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | BAX | CASP3 | CASP9 | CDK2 | CDKN1A | CDKN1B | TP53 | All | |
Properties | Physical Elemental Topological |
InChi Key | ZQSIJRDFPHDXIC-UHFFFAOYSA-N |
InChi | 1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H |
SMILES | o1c2c(c(=O)c(c3ccc(O)cc3)c1)ccc(O)c2 |
SMART | [H]OC1=C([H])C([H])=C(C([H])=C1[H])C1=C([H])OC2=C(C([H])=C([H])C(O[H])=C2[H])C1=O |
CAS No. | 486-66-8 |
|
Structure Download |
|
Cross Refrence in other databases |
Super Natural | - |
CTD | C004742 |
HIT | C0282 |
NCI-60 GI50 data | - |
Suppliers | ABBLIS Chemicals, Abbott Labs, ABI Chem, AKos Consulting & Solutions, Ambinter, Calbiochem, ChemFrog, ChemMol, FINETECH, Hangzhou
APIChem Technology, IS Chemical Technology, MolPort, MP Biomedicals, R&D Chemicals, Selleck Chemicals, Sigma-Aldrich, TCI (Tokyo Chemical
Industry), Therapeutic Targets Database, TimTec, Tyger Scientific, Vitas-M Laboratory, ZINC, |
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 |