NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound1-[3-(4-hydroxyphenyl)-2-propenoate]-beta-D-glucopyranoside
NPACT-IdNPACT00028
IUPAC-
Synonyms-
PubChem Id-
ClassUnknown
In-vitro anticancer activtiy 2 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyICCOBDHPGDDITK-XRCNZUDPSA-N
InChi1S/C16H20O8/c17-7-12-13(20)14(21)15(22)16(24-12)23-8-11(19)6-3-9-1-4-10(18)5-2-9/h1-6,12-18,20-22H,7-8H2/b6-3+/t12-,13-,14+,15-,16-/m0/s1
SMILESc1cc(ccc1/C=C/C(=O)CO[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)CO)O
SMART[H]C(=C([H])C1=CC=C(O)C=C1)C(=O)CO[C@@]1([H])O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1O
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   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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