NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a a
CompoundPinocembrin
NPACT-IdNPACT00868
IUPAC-
SynonymsDihydrochrysin;Galangin flavanone
PubChem Id238782
ClassFlavonoid
In-vitro anticancer activtiy 2 cancer cell lines
In-Vivo anticancer activtiy No
TargetsBAX | BCL2L1 | CASP3 | CASP9 | CYCS | PARP1 | TP53 |   All | 
Properties Physical   Elemental  Topological
InChi KeyURFCJEUYXNAHFI-UHFFFAOYSA-N
InChi1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2
SMILESO1[C@H](CC(=O)c2c1cc(O)cc2O)c1ccccc1
SMARTOC1=CC(O)=C2C(=O)C[C@@H](OC2=C1)C1=CC=CC=C1
CAS No.480-39-7
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C016063
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, Ambinter, Angene International, ChemFrog, IS Chemical Technology, MolPort, R&D Chemicals, 
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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