NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
a
Compound3,22-dioxo-20-taraxastene
NPACT-IdNPACT01469
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activity 3 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyPVKQKARZQXCEBC-WQIQKMMHSA-N
InChi1S/C30H46O2/c1-18-17-24(32)28(6)15-16-29(7)20(25(28)19(18)2)9-10-22-27(5)13-12-23(31)26(3,4)21(27)11-14-30(22,29)8/h17,19-22,25H,9-16H2,1-8H3/t19-,20?,21?,22?,25?,27+,28+,29-,30-/m1/s1
SMILESC1CC(=O)C(C2[C@]1(C1[C@@](CC2)([C@]2(C(CC1)C1[C@@](CC2)(C(=O)C=C([C@H]1C)C)C)C)C)C)(C)C
SMART[#6][C@H]1C2C3CCC4[C@@]5([#6])CCC(=O)[C@@]([#6])([#6])C5CC[C@@]4([#6])[C@]3([#6])CC[C@@]2([#6])C(=O)C=C1[#6]
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   No
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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