Compound | Fenchone |
NPACT-Id | NPACT00579 |
IUPAC | 2,2,4-trimethylbicyclo[2.2.1]heptan-3-one |
Synonyms | alpha-Fenchone;iso-Fenchone |
PubChem Id | 14525 |
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 | LHXDLQBQYFFVNW-UHFFFAOYSA-N |
InChi | 1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3 |
SMILES | O=C1[C@]2(C[C@@H](C1(C)C)CC2)C |
SMART | [H]C([H])([H])[C@]1(C(=O)[C@]2(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]1([H])C2([H])[H])C([H])([H])[H] |
CAS No. | 4695-62-9 |
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Structure Download |
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Cross Refrence in other databases |
Super Natural | 001195795 |
CTD | C027327 |
HIT | - |
NCI-60 GI50 data | - |
Suppliers | ABI Chem, Ambinter, ChemExper Chemical Directory, ChemFrog, ChemMol, Enamine, MolPort, MP Biomedicals, Sigma-Aldrich, TCI (Tokyo
Chemical Industry), Vitas-M Laboratory, |
Drug-Likeliness Filters | Lipinski's rule of five | Yes |
Ghose filter | No |
Veber filter | Yes |
Muegge Filter | No |
Similarity Search | Human metabolite database | FDA approved drugs |