NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound1,2-Dihydro-1,2,3-trihydroxy-9-(4-methoxyphenyl)phenalene
NPACT-IdNPACT01516
IUPAC(1S,2R,3S)-4-(4-methoxyphenyl)-2,3-dihydro-1H-phenalene-1,2,3-triol
Synonyms-
PubChem Id11034619
ClassPolycyclic aromatic natural products
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyUBACNSNNFBHJLG-SLFFLAALSA-N
InChi1S/C20H18O4/c1-24-13-8-5-11(6-9-13)14-10-7-12-3-2-4-15-16(12)17(14)19(22)20(23)18(15)21/h2-10,18-23H,1H3/t18-,19-,20+/m0/s1
SMILESO[C@H]1[C@@H](O)c2c3c([C@@H]1O)cccc3ccc2c1ccc(OC)cc1
SMART[#6]OC1=CC=C(C=C1)C1=C2[C@H](O)[C@H](O)[C@@H](O)C3=CC=CC(C=C1)=C23
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.