| Compound | phaseollin |
| NPACT-Id | NPACT01291 |
| IUPAC | - |
| Synonyms | 3h,7h-furo(3,2-c:5,4-f')bis(1)benzopyran-10-ol, 6b,12b-dihydro-3,3-dimethyl-,(6br-cis)-;Pterocarpan;Phaseolin fungicide |
| PubChem Id | 91572 |
| Class | Flavonoid |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | CASP3 | CASP7 | MAPK1 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | LWTDZKXXJRRKDG-KXBFYZLASA-N |
| InChi | 1S/C20H18O4/c1-20(2)8-7-14-16(24-20)6-5-12-15-10-22-17-9-11(21)3-4-13(17)19(15)23-18(12)14/h3-9,15,19,21H,10H2,1-2H3/t15-,19-/m0/s1 |
| SMILES | O1[C@@H]2[C@H](c3c1c1c(OC(C=C1)(C)C)cc3)COc1c2ccc(O)c1 |
|
SMART | [H]OC1=C([H])C2=C(C([H])=C1[H])[C@]1([H])OC3=C(C([H])=C([H])C4=C3C([H])=C([H])[C@](O4)(C([H])([H])[H])C([H])([H])[H])[C@]1([H])C([H])([H])O2 |
| CAS No. | 13401-40-6 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C053345 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | AAA Chemistry, ABI Chem, Therapeutic Targets Database, |
| 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 |