BDBM50139595 (S)-3-[(R)-13-Hydroxy-13-((2R,5R,1'S,3'R)-5'-undecyl-octahydro-[2,2']bifuranyl-5-yl)-tridecyl]-5-methyl-5H-furan-2-one::CHEMBL166222

SMILES: CCCCCCCCCCC[C@H]1CC[C@@H](O1)[C@H]1CC[C@@H](O1)[C@H](O)CCCCCCCCCCCCC1=C[C@H](C)OC1=O

InChI Key: InChIKey=HTKRHXGPOODCSB-CXPQHEJVSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50139595   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mitochondrial complex I; NADH oxidoreductase (Bos taurus)	BDBM50139595 ((S)-3-[(R)-13-Hydroxy-13-((2R,5R,1'S,3'R)-5'-undec...) Show SMILES CCCCCCCCCCC[C@H]1CC[C@@H](O1)[C@H]1CC[C@@H](O1)[C@H](O)CCCCCCCCCCCCC1=C[C@H](C)OC1=O |t:37| Show InChI InChI=1S/C37H66O5/c1-3-4-5-6-7-10-14-17-20-23-32-25-26-35(41-32)36-28-27-34(42-36)33(38)24-21-18-15-12-9-8-11-13-16-19-22-31-29-30(2)40-37(31)39/h29-30,32-36,38H,3-28H2,1-2H3/t30-,32-,33+,34+,35+,36+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibitory concentration needed to halve the control NADH oxidase activity in bovine heart submitochondrial particles (SMP)				Bioorg Med Chem Lett 14: 779-82 (2004) BindingDB Entry DOI: 10.7270/Q2ZC8290
					More data for this Ligand-Target Pair