NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound3,8-dihydroxy-9-methoxypterocarpan
NPACT-IdNPACT01076
IUPAC-
Synonyms3,9-Dihydroxy-8-methoxypterocarpan;8-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol;
PubChem Id5318889
ClassFlavonoid
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyNYGZYUAVZPIKBZ-UHFFFAOYSA-N
InChi1S/C16H14O5/c1-19-15-5-10-11-7-20-13-4-8(17)2-3-9(13)16(11)21-14(10)6-12(15)18/h2-6,11,16-18H,7H2,1H3
SMILESO1C2C(c3c1cc(O)c(OC)c3)COc1c2ccc(O)c1
SMART[H]OC1=C([H])C2=C(C([H])=C1[H])[C@@]1([H])OC3=C([H])C(O[H])=C(OC([H])([H])[H])C([H])=C3[C@@]1([H])C([H])([H])O2
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers 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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