NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compoundvibsanin C
NPACT-IdNPACT01531
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyCTZHAVGBLACXEB-MZAZUOCOSA-N
InChi1S/C24H34O5/c1-6-7-8-11-24(5)12-9-19(16-25)23(28)20(15-18(4)26)21(24)10-13-29-22(27)14-17(2)3/h6-7,9-10,13-14,20-21,25H,8,11-12,15-16H2,1-5H3/b7-6-,13-10+
SMILESC1(=O)C(=CCC(C(/C=C/OC(=O)C=C(C)C)C1CC(=O)C)(C)CC/C=CC)CO
SMART[#6]C=C/CCC1([#6])CC=C(CO)C(=O)C(CC([#6])=O)C1C=COC(=O)C=C([#6])[#6]
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.