BDBM50284045 (2S,4R,5S,6S)-4-Acetoxymethyl-2-((4S,5R)-4-acetoxy-5-methyl-3-methylene-6-phenyl-hexyl)-2-carbamoyl-5-hydroxy-[1,3]dioxane-4,5,6-tricarboxylic acid::CHEMBL158525

SMILES C[C@H](Cc1ccccc1)[C@H](OC(C)=O)C(=C)CC[C@@]1(O[C@H](C(O)=O)[C@@](O)(C(O)=O)[C@@](COC(C)=O)(O1)C(O)=O)C(N)=O

InChI Key InChIKey=CLZXIGAYWXBXMP-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 = 50284045   

TargetSqualene synthase(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50284045((2S,4R,5S,6S)-4-Acetoxymethyl-2-((4S,5R)-4-acetoxy...)
Affinity DataIC50: 270nMAssay Description:In vitro inhibitory concentration against squalene synthase from male rat liver microsomesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2010
Entry Details Article