BDBM50250738 Acetic acid (1R,5aR,8R,9R,10aS,11R,12R,12aR)-1-((R)-1,5-dimethyl-4-methylene-hexyl)-11-hydroxy-6,6,8,8,10a,12a-hexamethyl-2,4,5,5a,6,6a,9a,10,10a,11,12,12a-dodecahydro-1H-7,9-dioxa-dicyclopenta[a,h]phenanthren-12-yl ester::CHEMBL455285

SMILES CC(C)C(=C)CC[C@@H](C)[C@H]1CC=C2C3=C([C@@H](O)[C@H](OC(C)=O)[C@]12C)[C@@]1(C)C[C@H]2OC(C)(C)O[C@@H]2C(C)(C)[C@@H]1CC3

InChI Key InChIKey=HNPSAOSDIVMODU-ZUFAWSGESA-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 = 50250738   

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

Curated by ChEMBL
LigandPNGBDBM50250738(Acetic acid (1R,5aR,8R,9R,10aS,11R,12R,12aR)-1-((R...)
Affinity DataIC50: >5.00E+4nMAssay Description:Inhibition of Escherichia coli ECOR1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed