Compound | Farnesiferol C |
NPACT-Id | NPACT00576 |
IUPAC | 7-[(E)-3-methyl-5-[(1S,3S,4R)-2,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]pent-2-enoxy]chromen-2-one |
Synonyms | - |
PubChem Id | 11090246 |
Class | Benzopyranoids |
In-vitro anticancer activity | 1 cancer cell lines |
In-Vivo anticancer activity | Yes |
Targets | No targets found |
Properties | Physical Elemental Topological |
InChi Key | OCHZHKVSLMBEJP-IZQXFRHZSA-N |
InChi | 1S/C24H30O4/c1-16(5-9-20-23(2,3)21-11-13-24(20,4)28-21)12-14-26-18-8-6-17-7-10-22(25)27-19(17)15-18/h6-8,10,12,15,20-21H,5,9,11,13-14H2,1-4H3/b16-12+/t20-,21-,24+/m0/s1 |
SMILES | O1[C@]2([C@H](C([C@@H]1CC2)(C)C)CC/C(=C/COc1cc2oc(=O)ccc2cc1)/C)C |
SMART | [H]C(=C(C([H])([H])[H])C([H])([H])C([H])([H])[C@]1([H])[C@@]2(O[C@@]([H])(C([H])([H])C2([H])[H])[C@]1(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])C([H])([H])OC1=C([H])C2=C(C([H])=C([H])C(=O)O2)C([H])=C1[H] |
CAS No. | - |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | - |
CTD | C553326 |
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 |