Compound | Garcidepsidone A |
NPACT-Id | NPACT00593 |
IUPAC | 2,3,7,9-tetrahydroxy-4,8,10-tris(3-methylbut-2-enyl)benzo[b][1,4]benzodioxepin-6-one |
Synonyms | - |
PubChem Id | 10504902 |
Class | Simple aromatic natural products |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | No |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | QNAGATQUKNWGFB-UHFFFAOYSA-N |
InChi | 1S/C28H32O7/c1-14(2)7-10-17-23(30)18(11-8-15(3)4)27-22(25(17)32)28(33)35-26-19(12-9-16(5)6)24(31)20(29)13-21(26)34-27/h7-9,13,29-32H,10-12H2,1-6H3 |
SMILES | O1c2c(c(O)c(c(O)c2C(=O)Oc2c1cc(O)c(O)c2CC=C(C)C)CC=C(C)C)CC=C(C)C |
SMART | [H]OC1=C([H])C2=C(OC(=O)C3=C(O[H])C(=C(O[H])C(=C3O2)C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C(=C1O[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[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 | No |
Ghose filter | No |
Veber filter | Yes |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |