Ligand name: 2-{[(3alpha,5alpha,7alpha,8alpha,10alpha,12alpha,17alpha)-3,12-bis{2-[(4-O-alpha-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]ethoxy}cholan-7-yl]oxy}ethyl 4-O-alpha-D-glucopyranosyl-beta-D-glucopyranoside
PDB ligand accession: CH0
DrugBank: n/a
PubChem: 49866788
ChEMBL: n/a
InChI Key: YGUVIEOMNBFSRV-GLUVFYGUSA-N
SMILES: CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)OCCOC5C(C(C(C(O5)CO)OC6C(C(C(C(O6)CO)O)O)O)O)O)C)OCCOC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)O)O)O)O)OCCOC9C(C(C(C(O9)CO)OC1C(C(C(C(O1)CO)O)O)O)O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Steroids and steroid derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P00178

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3KW4	Download	Experimental	e3kw4A1	Cytochrome P450	LigPlot