NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
CompoundRhinacanthin B
NPACT-IdNPACT00907
IUPAC-
Synonyms-
PubChem Id-
ClassPolycyclic aromatic natural products
In-vitro anticancer activity 5 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyFJJLEZNYBRUPKT-VMXGVUMBSA-N
InChi1S/C25H28O5/c1-6-15(2)10-9-11-16(3)24(28)29-20-14-19-21(26)17-12-7-8-13-18(17)22(27)23(19)30-25(20,4)5/h6-8,11-13,20H,9-10,14H2,1-5H3/b15-6+,16-11+/t20-/m1/s1
SMILESc1cccc2c1C(=O)C1=C(C2=O)C[C@H](C(O1)(C)C)OC(=O)/C(=C/CC/C(=C/C)/C)/C
SMART[#6]C=C(/[#6])CCC=C(/[#6])C(=O)O[C@@H]1CC2=C(O[C@]1([#6])[#6])C(=O)C1=CC=CC=C1C2=O
CAS No.119626-46-9
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.