BDBM50283623 (1S,3S,4S,5R,6R,7R)-6-((E)-4,6-Dimethyl-oct-2-enoyloxy)-4,7-dihydroxy-1-((4S,5R)-4-hydroxy-5-(S)-methyl-3-methylene-6-(S)-phenyl-hexyl)-2,8-dioxa-bicyclo[3.2.1]octane-3,4,5-tricarboxylic acid::CHEMBL421169

SMILES C=C(CC[C@]12O[C@H](C(=O)O)[C@@](O)(C(=O)O)[C@](C(=O)O)(O1)[C@H](OC(=O)/C=C/[C@@H](C)C[C@@H](C)CC)[C@H]2O)[C@@H](O)[C@H](C)Cc1ccccc1

InChI Key InChIKey=YQJGFEMAMZRZOE-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 = 50283623   

TargetSqualene synthase(Rat)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50283623BDBM50283623((1S,3S,4S,5R,6R,7R)-6-((E)-4,6-Dimethyl-oct-2-enoy...)
Affinity DataIC50: 5nMAssay Description:Inhibitory concentration against mammalian Squalene synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/19/2010
Entry Details Article