NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound13-beta, 21-Dihydroxyeurycomanol
NPACT-IdNPACT01462
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activity 2 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyKRHGIMOWBXXKSA-IJNPIEEJSA-N
InChi1S/C20H28O11/c1-7-3-9(22)11(23)16(2)8(7)4-10-17-6-30-19(28,14(16)17)15(26)18(27,5-21)20(17,29)12(24)13(25)31-10/h3,8-12,14-15,21-24,26-29H,4-6H2,1-2H3/t8-,9-,10+,11+,12-,14+,15+,16+,17+,18-,19-,20-/m0/s1
SMILES[C@H]1([C@H](C=C([C@H]2[C@]1([C@@H]1[C@@]34[C@@H](C2)OC(=O)[C@@H]([C@]3([C@@]([C@H]([C@]1(OC4)O)O)(CO)O)O)O)C)C)O)O
SMART[H][C@]12[C@]3(O)OC[C@@]11[C@@H](C[C@@]4([H])C([#6])=C[C@H](O)[C@@H](O)[C@]24[#6])OC(=O)[C@H](O)[C@@]1(O)[C@](O)(CO)[C@H]3O
CAS No.-
Structure
Download

Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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