BDBM19104 (2S)-N-[(1R,6S,7S,8R,11R,12S,14R,15S,16R)-15-[(1S)-1-(dimethylamino)ethyl]-14-hydroxy-7-(hydroxymethyl)-7,12,16-trimethyl-18-oxotetracyclo[9.7.0.0^{3,8}.0^{12,16}]octadec-3-en-6-yl]-2-methylbutanamide::triterpene-type steroidal alkaloid, 8d

SMILES [H][C@@]12CC3=CC[C@H](NC(=O)[C@@H](C)CC)[C@@](C)(CO)[C@]3([H])CC[C@@]1([H])[C@]1(C)C[C@@H](O)[C@H]([C@H](C)N(C)C)[C@@]1(C)CC2=O

InChI Key InChIKey=OOBJCUGOYDSDKU-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 19104   

TargetAcetylcholinesterase(Electric eel)
Cnrs

LigandPNGBDBM19104((2S)-N-[(1R,6S,7S,8R,11R,12S,14R,15S,16R)-15-[(1S)...)
Affinity DataIC50: 105nMpH: 8.0 T: 2°CAssay Description:Inhibition of AChE activity was determined by the spectroscopic method of Ellman using acetylthiocholine iodide as substrate, in 96-well microtiter p...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/15/2007
Entry Details Article
PubMed
TargetCholinesterase(Human)
Cnrs

LigandPNGBDBM19104((2S)-N-[(1R,6S,7S,8R,11R,12S,14R,15S,16R)-15-[(1S)...)
Affinity DataIC50: 1.00E+4nMpH: 8.0 T: 2°CAssay Description:Inhibition of BuChE activity was determined by the spectroscopic method of Ellman using butyrylthiocholine iodide as substrate, in 96-well microtiter...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/15/2007
Entry Details Article
PubMed