BDBM50250745 (2R,3R,5R,10S,11R,12R,13R,17R)-3,11-dihydroxy-2-(methoxymethoxy)-4,4,10,13-tetramethyl-17-((R)-6-methyl-5-methyleneheptan-2-yl)-2,3,4,5,6,7,10,11,12,13,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-12-yl acetate::CHEMBL503134

SMILES COCO[C@@H]1C[C@@]2(C)[C@@H](CCC3=C2[C@@H](O)[C@H](OC(C)=O)[C@]2(C)[C@H](CC=C32)[C@H](C)CCC(=C)C(C)C)C(C)(C)[C@H]1O

InChI Key InChIKey=PMEIROXFAZXWQG-IPCVMKMHSA-N

Data  1 IC50

  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 = 50250745   

TargetType II restriction enzyme EcoRI(Escherichia coli)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50250745((2R,3R,5R,10S,11R,12R,13R,17R)-3,11-dihydroxy-2-(m...)
Affinity DataIC50: >5.00E+4nMAssay Description:Inhibition of Escherichia coli ECOR1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed