NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound4'-hydroxy-7-methoxyflavan
NPACT-IdNPACT01091
IUPAC-
Synonyms4-[(2s)-7-methoxy-3,4-dihydro-2h-chromen-2-yl]phenol
PubChem Id185609
ClassFlavonoid
In-vitro anticancer activity 5 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyHQIYVJDLRVEGDX-HNNXBMFYSA-N
InChi1S/C16H16O3/c1-18-14-8-4-12-5-9-15(19-16(12)10-14)11-2-6-13(17)7-3-11/h2-4,6-8,10,15,17H,5,9H2,1H3/t15-/m0/s1
SMILESO1[C@@H](CCc2c1cc(OC)cc2)c1ccc(O)cc1
SMART[H]OC1=C([H])C([H])=C(C([H])=C1[H])[C@@]1([H])OC2=C(C([H])=C([H])C(OC([H])([H])[H])=C2[H])C([H])([H])C1([H])[H]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C433580
HIT   -
NCI-60 GI50 data   -
Suppliers AAA Chemistry, ABI Chem, 
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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