Compound | ridentin |
NPACT-Id | NPACT01306 |
IUPAC | - |
Synonyms | (3aS,7R,9S,10Z,11aR)-7,9-dihydroxy-10-methyl-3,6-dimethylidene-4,5,7,8,9,11a-hexahydro-3aH-cyclodeca[b]furan-2-one;Cyclodeca(b)furan-2(3H)-one, 3a,4,5,6,7,8,9,11a-octahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-, (3aS-(3aR*,7S*,9R*,10E,11aS*))-; |
PubChem Id | 6441492 |
Class | Terpenoids |
In-vitro anticancer activity | 2 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | KQCHEWVHXSAJIA-ISMVJUEGSA-N |
InChi | 1S/C15H20O4/c1-8-4-5-11-10(3)15(18)19-14(11)6-9(2)13(17)7-12(8)16/h6,11-14,16-17H,1,3-5,7H2,2H3/b9-6-/t11-,12+,13-,14+/m0/s1 |
SMILES | O1[C@H]2[C@@H](CCC(=C)[C@H](O)C[C@H](O)C(=C2)C)C(=C)C1=O |
SMART | [H]O[C@]1([H])C(=C([H])/[C@@]2([H])OC(=O)C(=C([H])[H])[C@]2([H])C([H])([H])C([H])([H])C(=C([H])[H])[C@]([H])(O[H])C1([H])[H])C([H])([H])[H] |
CAS No. | 28148-84-7 |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | - |
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 |