NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundFenchone
NPACT-IdNPACT00579
IUPAC2,2,4-trimethylbicyclo[2.2.1]heptan-3-one
Synonymsalpha-Fenchone;iso-Fenchone
PubChem Id14525
ClassTerpenoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyLHXDLQBQYFFVNW-UHFFFAOYSA-N
InChi1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3
SMILESO=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
Structure
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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 SearchHuman metabolite databaseFDA approved drugs

 






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