Ligand name: 2-{[(4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranosyl)oxy]methyl}-4-{[(3beta,9beta,14beta,17beta,25R)-spirost-5-en-3-yl]oxy}butyl 4-O-alpha-D-glucopyranosyl-alpha-D-glucopyranoside
PDB ligand accession: Q7G
DrugBank: n/a
PubChem: 155817667
ChEMBL: n/a
InChI Key: LKBFXDNKNZXHHW-NXLTVWPKSA-N
SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)OCCC(COC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)O)O)O)O)COC9C(C(C(C(O9)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)C)C)OC1
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Steroids and steroid derivatives
      • Subclass: Steroidal glycosides

List of PDB structures and/or AlphaFold models with target protein Q9C9Z5

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8BPX	Download	Experimental	e8bpxH1 e8bpxX2 e8bpxa1 e8bpxH1 e8bpxK1 e8bpxZ1 e8bpxa1 e8bpxH1 e8bpxa1	Sodium/proton antiporter subunits-like p8-MTCP1-related Mitochondrial complex I, MWFE subunit Sodium/proton antiporter subunits-like NADH-quinone oxidoreductase subunit K Mitochondrial complex I, B16.6 subunit Mitochondrial complex I, MWFE subunit Sodium/proton antiporter subunits-like Mitochondrial complex I, MWFE subunit	LigPlot
8BEF	Download	Experimental	e8befH1 e8befX2 e8befa1 e8befH1 e8befK1 e8befZ1 e8befa1 e8befH1 e8befa1	Sodium/proton antiporter subunits-like p8-MTCP1-related Mitochondrial complex I, MWFE subunit Sodium/proton antiporter subunits-like NADH-quinone oxidoreductase subunit K Mitochondrial complex I, B16.6 subunit Mitochondrial complex I, MWFE subunit Sodium/proton antiporter subunits-like Mitochondrial complex I, MWFE subunit	LigPlot