Compound | Dehydrofalcarinol |
NPACT-Id | NPACT00486 |
IUPAC | (3R,9Z)-heptadeca-1,9,16-trien-4,6-diyn-3-ol |
Synonyms | - |
PubChem Id | 13895593 |
Class | Aliphatic natural products |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | Yes |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | JRLHSTVTOOELAF-QXPKXGMISA-N |
InChi | 1S/C17H22O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)4-2/h3-4,10-11,17-18H,1-2,5-9,12H2/b11-10-/t17-/m1/s1 |
SMILES | O[C@H](C=C)C#CC#CC/C=CCCCCCC=C |
SMART | [H]O[C@@]([H])(C#CC#CC([H])([H])C([H])=C([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])=C(/[H])[H])C([H])=C([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 | Yes |
Veber filter | No |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |