BDBM50326746 (3S,3aR,4S,6S,6aR,7S,8S,9bS)-3a-hydroxy-3,6,9-trimethyl-8-((Z)-2-methylbut-2-enoyloxy)-7-(octanoyloxy)-2-oxo-2,3,3a,4,5,6,6a,7,8,9b-decahydroazuleno[4,5-b]furan-3,4,6-triyl tributyrate::CHEMBL1253589

SMILES CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)C(\C)=C/C)C(C)=C2[C@@H]3OC(=O)[C@@](C)(OC(=O)CCC)[C@@]3(O)[C@H](C[C@](C)(OC(=O)CCC)[C@@H]12)OC(=O)CCC

InChI Key InChIKey=HNPKZMPFTORRQD-NGBXUZPPSA-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 = 50326746   

TargetSarcoplasmic/endoplasmic reticulum calcium ATPase 1(Oryctolagus cuniculus)
University Of Copenhagen

Curated by ChEMBL
LigandPNGBDBM50326746((3S,3aR,4S,6S,6aR,7S,8S,9bS)-3a-hydroxy-3,6,9-trim...)
Affinity DataIC50:  11.1nMAssay Description:Inhibition of rabbit sarcoplasmic reticulum calcium ATPase by ATP regeneration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed