NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound11-beta-hydroxycephalotaxine beta-N-oxide
NPACT-IdNPACT01059
IUPAC-
Synonyms-
PubChem Id10958964
ClassAlkaloids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyINVLOFKFVTTYSR-DQDQBAQVSA-N
InChi1S/C18H21NO6/c1-23-15-7-18-3-2-4-19(18,22)8-12(20)10-5-13-14(25-9-24-13)6-11(10)16(18)17(15)21/h5-7,12,16-17,20-21H,2-4,8-9H2,1H3/t12-,16+,17+,18-,19+/m0/s1
SMILES[O-][N@+]12[C@@]3([C@@H]([C@H](O)C(=C3)OC)c3c([C@@H](O)C2)cc2OCOc2c3)CCC1
SMART[H]O[C@]1([H])C(OC([H])([H])[H])=C([H])[C@]23C([H])([H])C([H])([H])C([H])([H])[N@@+]2([O-])C([H])([H])[C@]([H])(O[H])C2=C([H])C4=C(OC([H])([H])O4)C([H])=C2[C@]13[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   No
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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