NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound12-Hydroxychiloscyphone
NPACT-IdNPACT00039
IUPAC1-[(1S,7S,7aS)-7,7a-dimethyl-1,2,3,5,6,7-hexahydroinden-1-yl]-2-(hydroxymethyl)prop-2-en-1-one
Synonyms-
PubChem Id10243131
ClassTerpenoids
In-vitro anticancer activtiy 1 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyNEUJHRQRRDXWQD-NJZAAPMLSA-N
InChi1S/C15H22O2/c1-10(9-16)14(17)13-8-7-12-6-4-5-11(2)15(12,13)3/h6,11,13,16H,1,4-5,7-9H2,2-3H3/t11-,13+,15+/m0/s1
SMILESO=C([C@@H]1[C@@]2([C@H](CCC=C2CC1)C)C)C(=C)CO
SMART[H]OC([H])([H])C(=C(/[H])[H])C(=O)[C@@]1([H])C([H])([H])C([H])([H])C2=C([H])C([H])([H])C([H])([H])[C@]([H])(C([H])([H])[H])[C@@]12C([H])([H])[H]
CAS No.-
Structure
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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 SearchHuman metabolite databaseFDA approved drugs

 






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