Compound | Argentinic acid G methyl ester |
NPACT-Id | NPACT01138 |
IUPAC | - |
Synonyms | - |
PubChem Id | 44566309 |
Class | Terpenoids |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | UILLACOBARHYAA-NGQJGVIASA-N |
InChi | 1S/C43H70O10/c1-13-25(5)35(45)38(47)52-30-22-42(10)29(27-20-28(51-23-27)19-24(3)4)15-16-31(42)43(11)33(53-39(48)36(46)26(6)14-2)21-32(40(7,8)49)41(9,37(30)43)18-17-34(44)50-12/h16,19,25-30,32-33,35-37,45-46,49H,13-15,17-18,20-23H2,1-12H3/t25-,26-,27-,28-, |
SMILES | O([C@H]1[C@H]2[C@](C3=CC[C@H]([C@@]3(C1)C)[C@@H]1C[C@H](OC1)C=C(C)C)([C@H](OC(=O)[C@H](O)[C@@H](CC)C)C[C@@H]([C@@]2(CCC(=O)OC)C)C(O)(C)C)C)C(=O)[C@H](O)[C@@H](CC)C |
SMART | [H]O[C@@]([H])(C(=O)O[C@]1([H])C([H])([H])[C@@]2(C(=C([H])C([H])([H])[C@@]2([H])[C@@]2([H])C([H])([H])O[C@]([H])(C([H])=C(C([H])([H])[H])C([H])([H])[H])C2([H])[H])[C@]2(C([H])([H])[H])[C@]([H])(OC(=O)[C@]([H])(O[H])[C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])C([H])([H])[C@]([H])([C@@](O[H])(C([H])([H])[H])C([H])([H])[H])[C@](C([H])([H])[H])(C([H])([H])C([H])([H])C(=O)OC([H])([H])[H])[C@@]12[H])C([H])([H])[H])[C@]([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H] |
CAS No. | - |
|
Structure Download |
|
Cross Refrence in other databases |
Super Natural | - |
CTD | - |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | NA, |
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 |