| Compound | Alpinumisoflavone |
| NPACT-Id | NPACT01128 |
| IUPAC | - |
| Synonyms | 2H,6H-Benzodipyran-6-one, 5-hydroxy-7-(4-hydroxyphenyl)-2,2-dimethyl-;5-hydroxy-7-(4-hydroxyphenyl)-2,2-dimethylpyrano[3,2-g]chromen-6-one;5-Hydroxy-7-(p-hydroxyphenyl)-2,2-dimethyl-2H,6H-benzodipyran-6-one; |
| PubChem Id | 5490139 |
| Class | Flavonoid |
| In-vitro anticancer activity | 1 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | CASP3 | CASP7 | JUN | MAP2K1 | MAPK1 | NFKBIA | NOS2 | All | |
| Properties | Physical Elemental Topological |
| InChi Key | RQAMSFTXEFSBPK-UHFFFAOYSA-N |
| InChi | 1S/C20H16O5/c1-20(2)8-7-13-15(25-20)9-16-17(18(13)22)19(23)14(10-24-16)11-3-5-12(21)6-4-11/h3-10,21-22H,1-2H3 |
| SMILES | O1C(C=Cc2c1cc1occ(c(=O)c1c2O)c1ccc(O)cc1)(C)C |
|
SMART | [H]OC1=C([H])C([H])=C(C([H])=C1[H])C1=C([H])OC2=C([H])C3=C(C([H])=C([H])[C@@](O3)(C([H])([H])[H])C([H])([H])[H])C(O[H])=C2C1=O |
| CAS No. | 34086-50-5 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C000154 |
| 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 |