NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compoundeupafolin
NPACT-IdNPACT00569
IUPAC2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxychromen-4-one
Synonyms6-Methoxyluteolin; Nepetin
PubChem Id5317284
ClassFlavonoid
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsBCL2 | BID | CASP3 | CASP6 | CASP7 | CASP8 | CASP9 | CYCS |   All | 
Properties Physical   Elemental  Topological
InChi KeyFHHSEFRSDKWJKJ-UHFFFAOYSA-N
InChi1S/C16H12O7/c1-22-16-11(20)6-13-14(15(16)21)10(19)5-12(23-13)7-2-3-8(17)9(18)4-7/h2-6,17-18,20-21H,1H3
SMILESo1c2c(c(O)c(OC)c(O)c2)c(=O)cc1c1cc(O)c(O)cc1
SMART[#6]OC1=C(O)C2=C(OC(=CC2=O)C2=CC(O)=C(O)C=C2)C=C1O
CAS No.520-11-6
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C503624
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, Amadis Chemical, Ambinter, MolPort, R&D Chemicals, 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

 






Copyright © 2012. Subhash M. Agagrwal. All Rights Reserved.