BDBM50490810 R-(+)-MARMIN-6'-PALMITATE::R-(+)-Marmin-6''-palmitate

SMILES CCCCCCCCCCCCCCCC(=O)O[C@H](CC\C(C)=C\COc1ccc2ccc(=O)oc2c1)C(C)(C)O

InChI Key InChIKey=XXIJAXDMARSSBX-KEDDETGJSA-N

Data  2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50490810   

TargetNADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 9(Homo sapiens)
University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50490810(R-(+)-MARMIN-6'-PALMITATE | R-(+)-Marmin-6''-palmi...)
Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@H](CC\C(C)=C\COc1ccc2ccc(=O)oc2c1)C(C)(C)O
Show InChI InChI=1S/C35H54O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-33(36)41-32(35(3,4)38)23-19-28(2)25-26-39-30-22-20-29-21-24-34(37)40-31(29)27-30/h20-22,24-25,27,32,38H,5-19,23,26H2,1-4H3/b28-25+/t32-/m1/s1
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of mitochondrial ETC complex 1 in human T47D cells assessed as inhibition of 1% O2-induced HIF1 activation incubated for 30 mins prior to ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetNADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 9(Homo sapiens)
University of Mississippi

Curated by ChEMBL
LigandPNGBDBM50490810(R-(+)-MARMIN-6'-PALMITATE | R-(+)-Marmin-6''-palmi...)
Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@H](CC\C(C)=C\COc1ccc2ccc(=O)oc2c1)C(C)(C)O
Show InChI InChI=1S/C35H54O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-33(36)41-32(35(3,4)38)23-19-28(2)25-26-39-30-22-20-29-21-24-34(37)40-31(29)27-30/h20-22,24-25,27,32,38H,5-19,23,26H2,1-4H3/b28-25+/t32-/m1/s1
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of mitochondrial ETC complex 1 in human T47D cells assessed as inhibition of 1,10-phenanthroline-induced HIF1 activation incubated for 30 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid