Compound | Dawoensin A |
NPACT-Id | NPACT01183 |
IUPAC | - |
Synonyms | - |
PubChem Id | 10412708 |
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 | QEMZXZKSAIPCKG-INVVOPRQSA-N |
InChi | 1S/C26H36O8/c1-12-16-10-17(30)20-25(7)9-8-18(32-13(2)27)24(5,6)21(25)19(33-14(3)28)23(34-15(4)29)26(20,11-16)22(12)31/h16-21,23,30H,1,8-11H2,2-7H3/t16-,17+,18+,19-,20+,21-,23+,25+,26+/m1/s1 |
SMILES | O([C@@H]1[C@]23[C@H]([C@]4([C@H]([C@H]1OC(=O)C)C([C@@H](OC(=O)C)CC4)(C)C)C)[C@@H](O)C[C@H](C2)C(=C)C3=O)C(=O)C |
SMART | [H]O[C@@]1([H])C([H])([H])[C@@]2([H])C(=C(/[H])[H])C(=O)[C@@]3(C2([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])[C@]([H])(OC(=O)C([H])([H])[H])[C@]2([H])[C@@](C([H])([H])[H])(C([H])([H])[H])[C@@]([H])(OC(=O)C([H])([H])[H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])[C@]13[H] |
CAS No. | - |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | - |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | NA, |
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 |