BDBM50282957 (1S,3R,4S,5R,6R,7R)-4,7-Dihydroxy-1-((4S,5R)-4-hydroxy-5-methyl-3-oxo-6-phenyl-hexyl)-3-(1-hydroxy-vinyl)-6-((R)-6-methyl-4-methyl-octanoyloxy)-2,8-dioxa-bicyclo[3.2.1]octane-4,5-dicarboxylic acid::CHEMBL301051

SMILES CC[C@H](C)C[C@H](C)CCC(=O)O[C@@H]1[C@@H](O)[C@@]2(CCC(=O)[C@@H](O)[C@H](C)Cc3ccccc3)O[C@H](CO)[C@@](O)(C(=O)O)[C@]1(C(=O)O)O2

InChI Key InChIKey=ZECFQDJAIBQSMR-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 = 50282957   

TargetSqualene synthase(Rat)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50282957BDBM50282957((1S,3R,4S,5R,6R,7R)-4,7-Dihydroxy-1-((4S,5R)-4-hyd...)
Affinity DataIC50: 740nMAssay Description:In vitro inhibition of rat squalene synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2010
Entry Details Article