Compound | Artoindonesianins A |
NPACT-Id | NPACT00283 |
IUPAC | - |
Synonyms | - |
PubChem Id | 10603133 |
Class | Flavonoid |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | QBDLPAZRIQKEQK-WOJGMQOQSA-N |
InChi | 1S/C35H38O7/c1-17(2)9-8-10-18(3)11-12-20-30-19(13-14-34(4,5)41-30)28(38)27-29(39)21-15-22-25-26(32(21)40-31(20)27)23(36)16-24(37)33(25)42-35(22,6)7/h9,11,13-14,16,22,36-38H,8,10,12,15H2,1-7H3/b18-11+ |
SMILES | O1C([C@@H]2c3c1c(O)cc(O)c3c1oc3c(c(=O)c1C2)c(O)c1c(OC(C=C1)(C)C)c3C/C=C(/CCC=C(C)C)C)(C)C |
SMART | [H]OC1=C2O[C@@](C([H])([H])[H])(C([H])([H])[H])[C@]3([H])C2=C(C(O[H])=C1[H])C1=C(C(=O)C2=C(O1)C(=C1O[C@](C([H])=C([H])C1=C2O[H])(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C3([H])[H] |
CAS No. | - |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | C119457 |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | NA, |
Drug-Likeliness Filters | Lipinski's rule of five | No |
Ghose filter | No |
Veber filter | Yes |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |