BDBM50166731 (3S,4aR,6S,8R,8aR)-6-(2-Acetylamino-acetoxy)-3-furan-3-yl-4a,8a-dimethyl-1,5-dioxo-dodecahydro-2-oxa-phenanthrene-8-carboxylic acid methyl ester::CHEMBL196556

SMILES COC(=O)[C@@H]1C[C@H](OC(=O)CNC(C)=O)C(=O)C2[C@@]1(C)CCC1C(=O)O[C@@H](C[C@]21C)c1ccoc1

InChI Key InChIKey=FXDUHLZFDZUGKX-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50166731   

TargetKappa-type opioid receptor(Human)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50166731((3S,4aR,6S,8R,8aR)-6-(2-Acetylamino-acetoxy)-3-fur...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of [3H]diprenorphine binding to human Opioid receptor kappa 1 expressed in chinese hamster ovary cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/1/2012
Entry Details Article
PubMed