NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundPerseal C
NPACT-IdNPACT00854
IUPAC(2S,3R)-2,3-dihydro-2-(3,4-methylene- dioxyphenyl)-5-formyl-3-hydroxymethyl-7-methoxy benzofuran
Synonyms-
PubChem Id-
ClassLignans
In-vitro anticancer activtiy 4 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeySCLYIEQUSWZUJZ-UHFFFAOYSA-N
InChi1S/C18H14O6/c1-21-16-5-10(7-19)4-12-13(8-20)17(24-18(12)16)11-2-3-14-15(6-11)23-9-22-14/h2-7,20H,8-9H2,1H3
SMILESc1c(cc(c2c1c(c(o2)c1ccc2c(c1)OCO2)CO)OC)C=O
SMART[H]C(=O)C1=CC2=C(OC(=C2CO)C2=CC=C3OCOC3=C2)C(O[#6])=C1
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.