BDBM50285858 Acetic acid (3S,4S,6S,6aS,12bS)-3-acetoxy-4-acetoxymethyl-4,6a,12b-trimethyl-11-oxo-9-pyridin-3-yl-1,3,4,4a,5,6,6a,12b-octahydro-2H,11H-7,10-dioxa-benzo[a]anthracen-6-yl este::CHEMBL88457

SMILES CC(=O)OCC1(C)[C@H](CC[C@@]2(C)C1C[C@H](OC(C)=O)[C@@]1(C)Oc3cc(oc(=O)c3C=C21)-c1cccnc1)OC(C)=O

InChI Key InChIKey=CAIGEWOTKYYEDS-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 = 50285858   

TargetSterol O-acyltransferase 1(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50285858(Acetic acid (3S,4S,6S,6aS,12bS)-3-acetoxy-4-acetox...)
Affinity DataIC50: 5.80E+3nMAssay Description:Inhibitory activity against acyl-CoA:cholesterol O-acyltransferase (ACAT)More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2010
Entry Details Article