BDBM50286740 CHEMBL406262::Saponin derivative

SMILES CC1OC(COCCCC2OC(CCCOOC(=O)C34CCC(C)(C)CC3C3=CCC5[C@@]6(C)CCC(OC7OC(CCOCCC8OCC(O)C(O)C8OC8OCC(O)C(O)C8O)C(O)C(O)C7O)C(C)(C)C6CC[C@@]5(C)[C@]3(C)C[C@H]4O)C(OCC3OC(C)C(OCCCCCCCCC4OCC(O)C(OC5OCC(O)C(O)C5O)C4O)C(O)C3O)C(O)C2O)C(OC(=O)C(C)=CCC[C@](C)(O)C=C)C(OC(=O)C(\CO)=C\CC[C@](C)(O)C=C)C1O

InChI Key InChIKey=FHICGHSMIPIAPL-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50286740   

LigandPNGBDBM50286740(Saponin derivative | CHEMBL406262)
Affinity DataIC50: 4.00E+5nMAssay Description:Inhibitory activity against rat kidney Na+/K+ ATPase was determined by fiske subbarow methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2010
Entry Details Article