NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundFerruginin C
NPACT-IdNPACT01208
IUPAC-
Synonyms-
PubChem Id10436972
ClassPolycyclic aromatic natural products
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeySJEQJMPZRHDLDB-UHFFFAOYSA-N
InChi1S/C35H44O4/c1-20(2)10-12-25-24(9)18-29(36)30-27(25)19-28-31(33(30)38)32(37)26(13-11-21(3)4)34(39)35(28,16-14-22(5)6)17-15-23(7)8/h10-11,14-15,18-19,36-38H,12-13,16-17H2,1-9H3
SMILESO=C1C(c2c(C(=C1CC=C(C)C)O)c(O)c1c(c2)c(c(cc1O)C)CC=C(C)C)(CC=C(C)C)CC=C(C)C
SMART[H]OC1=C2C(O[H])=C3C(O[H])=C(C(=O)[C@@](C3=C([H])C2=C(C(=C1[H])C([H])([H])[H])C([H])([H])C([H])=C(/C([H])([H])[H])C([H])([H])[H])(C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H]
CAS No.-
Structure
Download

Cross Refrence in other databases
Super Natural   -
CTD   C478729
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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