| Compound | sanggenon C |
| NPACT-Id | NPACT01312 |
| IUPAC | - |
| Synonyms | 2-[(1S,5S,6R)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-1,3,8,10a-tetrahydroxy-5a-(3-methylbut-2-enyl)-[1]benzofuro[3,2-b]chromen-11-one |
| PubChem Id | 442458 |
| Class | Flavonoid |
| In-vitro anticancer activity | 2 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | XETHJOZXBVWLLM-QAHMVTMMSA-N |
| InChi | 1S/C40H36O12/c1-18(2)10-11-39-27-9-6-22(43)16-31(27)52-40(39,50)38(49)35-32(51-39)17-30(46)34(37(35)48)26-13-19(3)12-25(23-7-4-20(41)14-28(23)44)33(26)36(47)24-8-5-21(42)15-29(24)45/h4-10,13-17,25-26,33,41-46,48,50H,11-12H2,1-3H3/t25-,26+,33-,39?,40?/m1/s |
| SMILES | O1C2(C(Oc3c2ccc(O)c3)(O)C(=O)c2c1cc(O)c([C@@H]1[C@@H]([C@H](CC(=C1)C)c1c(O)cc(O)cc1)C(=O)c1c(O)cc(O)cc1)c2O)CC=C(C)C |
|
SMART | [H]OC1=C([H])C2=C(C([H])=C1[H])[C@@]1(OC3=C([H])C(O[H])=C(C(O[H])=C3C(=O)[C@@]1(O[H])O2)[C@@]1([H])C([H])=C(C([H])([H])[H])C([H])([H])[C@]([H])(C2=C(O[H])C([H])=C(O[H])C([H])=C2[H])[C@@]1([H])C(=O)C1=C(O[H])C([H])=C(O[H])C([H])=C1[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H] |
| CAS No. | 80651-76-9 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C477157 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | ABI Chem, |
| Drug-Likeliness Filters | Lipinski's rule of five | No |
| Ghose filter | No |
| Veber filter | No |
| Muegge Filter | No |
| Similarity Search | Human metabolite database | FDA approved drugs |