Ligand name: (3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-pentan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol
PDB ligand accession: 4QM
DrugBank: n/a
PubChem: 657107
ChEMBL: n/a
InChI Key: PFZUIDNKXWIWBG-YHEMGIGTSA-N
SMILES: CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)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: Hydroxysteroids

List of PDB structures and/or AlphaFold models with target protein Q04307

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8BWS	Download	Experimental	e8bwsI1 e8bwsM1	Rubredoxin-like triple barrel	LigPlot