BDBM50285878 Acetic acid (3S,4S,6S,6aS,12R,12bS)-3-acetoxy-4-acetoxymethyl-12-methoxy-4,6a,12b-trimethyl-11-oxo-9-pyridin-3-yl-1,3,4,4a,5,6,6a,12,12a,12b-decahydro-2H,11H-7,10-dioxa-benzo[a]anthracen-6-yl ester::CHEMBL329587

SMILES CO[C@@H]1C2[C@@]3(C)CC[C@H](OC(C)=O)C(C)(COC(C)=O)C3C[C@H](OC(C)=O)[C@@]2(C)Oc2cc(oc(=O)c12)-c1cccnc1

InChI Key InChIKey=DQWNWMYCJXNGFC-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 = 50285878   

TargetSterol O-acyltransferase 1(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50285878(Acetic acid (3S,4S,6S,6aS,12R,12bS)-3-acetoxy-4-ac...)
Affinity DataIC50: 3.80E+4nMAssay 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