NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundOctadeca-9,11,13-triynoic acid
NPACT-IdNPACT01285
IUPAC-
Synonyms-
PubChem Id11778027
ClassPolyketides
In-vitro anticancer activity 4 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyCBWJECXEMSFLLW-UHFFFAOYSA-N
InChi1S/C18H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-4,11-17H2,1H3,(H,19,20)
SMILESOC(=O)CCCCCCCC#CC#CC#CCCCC
SMART[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C#CC#CC#CC([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]
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   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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