NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compoundacacetin
NPACT-IdNPACT00210
IUPAC5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
Synonyms4'-Methoxyapigenin; Linarigenin; Buddleoflavonol; Akatsetin
PubChem Id5280442
ClassFlavonoid
In-vitro anticancer activity 4 cancer cell lines
In-Vivo anticancer activity Yes
TargetsAKT1 | CDKN1A | HIF1A | TP53 | VEGFA |   All | 
Properties Physical   Elemental  Topological
InChi KeyDANYIYRPLHHOCZ-UHFFFAOYSA-N
InChi1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3
SMILESo1c2c(c(=O)cc1c1ccc(OC)cc1)c(O)cc(O)c2
SMART[H]OC1=C([H])C(O[H])=C2C(=O)C([H])=C(OC2=C1[H])C1=C([H])C([H])=C(OC([H])([H])[H])C([H])=C1[H]
CAS No.480-44-4
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C023717
HIT   C0348
NCI-60 GI50 data   -
Suppliers Abbott Labs, ABI Chem, Ambinter, ChemFrog, Chemical Synthesis Database, ChemMol, IS Chemical Technology, MolPort, MP Biomedicals, R&D Chemicals, Sigma-Aldrich, Therapeutic Targets Database, TimTec, ZINC, 
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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