Compound | 6-dehydroxylongilactone |
NPACT-Id | NPACT01538 |
IUPAC | - |
Synonyms | - |
PubChem Id | - |
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 | YOGMRMRYMHICAC-SRLAIAKCSA-N |
InChi | 1S/C20H28O6/c1-8-6-11(21)15(23)18(3)10(8)7-12-19(4)13(17(25)26-12)9(2)14(22)16(24)20(18,19)5/h6,9-10,12-16,22-24H,7H2,1-5H3/t9-,10?,12-,13-,14-,15-,16+,18-,19+,20-/m1/s1 |
SMILES | [C@H]1(C(=O)C=C(C2[C@]1([C@@]1([C@]3([C@@H](C2)OC(=O)[C@H]3[C@H]([C@H]([C@@H]1O)O)C)C)C)C)C)O |
SMART | [#6][C@@H]1[C@@H]2C(=O)O[C@@H]3CC4C([#6])=CC(=O)[C@@H](O)[C@]4([#6])[C@@]([#6])([C@@H](O)[C@@H]1O)[C@]23[#6] |
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 |