NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundPsorothamnones A
NPACT-IdNPACT00883
IUPAC11-acetyl-7,7,9-trimethyl-[1]benzofuro[3,2-b]chromene-6,8-dione
Synonyms-
PubChem Id10065574
ClassUnknown
In-vitro anticancer activtiy 5 cancer cell lines
In-Vivo anticancer activtiy No
TargetsPRKCA |   All | 
Properties Physical   Elemental  Topological
InChi KeyCQEHHYNZYRAVFN-UHFFFAOYSA-N
InChi1S/C20H16O5/c1-9-15-14(19(23)20(3,4)18(9)22)17-16(25-15)13(10(2)21)11-7-5-6-8-12(11)24-17/h5-8H,1-4H3
SMILESo1c2=C(C(=O)C(C(=O)c2c2Oc3c(C(=c12)C(=O)C)cccc3)(C)C)C
SMART[H]C1=C([H])C([H])=C2C(OC3=C4C(OC3=C2C(=O)C([H])([H])[H])=C(C(=O)[C@](C4=O)(C([H])([H])[H])C([H])([H])[H])C([H])([H])[H])=C1[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   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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