NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundVismiaguianone E
NPACT-IdNPACT01507
IUPAC8-benzoyl-5,7-dihydroxy-6-(3-methylbut-2-enyl)-4-phenyl-3,4-dihydrochromen-2-one
Synonyms-
PubChem Id10071240
ClassSimple aromatic natural products
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyBKIBEPYJFMPNLS-UHFFFAOYSA-N
InChi1S/C27H24O5/c1-16(2)13-14-19-25(30)22-20(17-9-5-3-6-10-17)15-21(28)32-27(22)23(26(19)31)24(29)18-11-7-4-8-12-18/h3-13,20,30-31H,14-15H2,1-2H3
SMILESO1c2c(C(CC1=O)c1ccccc1)c(O)c(c(O)c2C(=O)c1ccccc1)CC=C(C)C
SMART[#6]C([#6])=CCC1=C(O)C(C(=O)C2=CC=CC=C2)=C2OC(=O)CC(C3=CC=CC=C3)C2=C1O
CAS No.-
Structure
Download

Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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