NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound1,2,4-trihydroxynonadecane
NPACT-IdNPACT00024
IUPACnonadecane-1,2,4-triol
Synonyms-
PubChem Id10567452
ClassAliphatic natural products
In-vitro anticancer activity 6 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyBADVLZPPYIABDS-UHFFFAOYSA-N
InChi1S/C19H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)16-19(22)17-20/h18-22H,2-17H2,1H3
SMILESO[C@H](CCCCCCCCCCCCCCC)C[C@H](O)CO
SMART[#6]CCCCCCCCCCCCCC[C@@H](O)C[C@H](O)CO
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   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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