Ligand name: [(2R)-2-octanoyloxy-3-[oxidanyl-[(1R,2R,3S,4R,5R,6S)-2,3,6-tris(oxidanyl)-4,5-diphosphonooxy-cyclohexyl]oxy-phosphoryl]oxy-propyl] octanoate
PDB ligand accession: PIO
DrugBank: n/a
PubChem: 9543520
ChEMBL: n/a
InChI Key: XLNCEHRXXWQMPK-MJUMVPIBSA-N
SMILES: CCCCCCCC(=O)OCC(COP(=O)(O)OC1C(C(C(C(C1O)OP(=O)(O)O)OP(=O)(O)O)O)O)OC(=O)CCCCCCC
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein P62812

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
8G5G Download Experimental e8g5gA2
Neurotransmitter-gated ion-channel transmembrane pore
LigPlot
8G4N Download Experimental e8g4nA1
e8g4nC2
Neurotransmitter-gated ion-channel transmembrane pore
Neurotransmitter-gated ion-channel transmembrane pore
LigPlot
8G4X Download Experimental e8g4xA1
Neurotransmitter-gated ion-channel transmembrane pore
LigPlot
8FOI Download Experimental e8foiA2
e8foiC2
Neurotransmitter-gated ion-channel transmembrane pore
Neurotransmitter-gated ion-channel transmembrane pore
LigPlot
8G5F Download Experimental e8g5fC1
Neurotransmitter-gated ion-channel transmembrane pore
LigPlot
8G5H Download Experimental e8g5hC1
Neurotransmitter-gated ion-channel transmembrane pore
LigPlot