NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundErybraedin A
NPACT-IdNPACT00557
IUPAC-
Synonyms4-Prenylphaseollidin
PubChem Id362562
ClassFlavonoid
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyHOGHBEDTLGAJAS-UHFFFAOYSA-N
InChi1S/C25H28O4/c1-14(2)5-7-17-21(26)12-10-19-23(17)28-13-20-16-9-11-22(27)18(8-6-15(3)4)24(16)29-25(19)20/h5-6,9-12,20,25-27H,7-8,13H2,1-4H3
SMILESO1[C@H]2[C@@H](c3c1c(c(O)cc3)CC=C(C)C)COc1c2ccc(O)c1CC=C(C)C
SMART[#6]C([#6])=CCC1=C(O)C=CC2=C1O[C@H]1[C@@H]2COC2=C1C=CC(O)=C2CC=C([#6])[#6]
CAS No.119269-76-0
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, Ambinter, 
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.