NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound1,7-Bis(4-hydroxyphenyl)hepta-4E,6E-dien-3-one
NPACT-IdNPACT01406
IUPAC(4E,6E)-1,7-bis(4-hydroxyphenyl)hepta-4,6-dien-3-one
Synonyms-
PubChem Id10613719
ClassFlavonoid
In-vitro anticancer activtiy 3 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyQIROPQQWKBMABC-ZPUQHVIOSA-N
InChi1S/C19H18O3/c20-17(10-7-16-8-13-19(22)14-9-16)4-2-1-3-15-5-11-18(21)12-6-15/h1-6,8-9,11-14,21-22H,7,10H2/b3-1+,4-2+
SMILESO=C(CCc1ccc(O)cc1)/C=C/C=C/c1ccc(O)cc1
SMARTOC1=CC=C(CCC(=O)C=CC=CC2=CC=C(O)C=C2)C=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.