Ligand name: (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-6-(METHOXYMETHYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL
PDB ligand accession: JJ3
DrugBank: DB08020
PubChem: 9927355
ChEMBL: CHEMBL236086
InChI Key: RHQLNMNKTIOREN-AOIWGVFYSA-N
SMILES: COCc1cc(cc2c1OC(C3C2CCC3)c4ccc(cc4)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Flavonoids
      • Subclass: Hydroxyflavonoids

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P03372

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2QE4	Download	Experimental	e2qe4A1 e2qe4B1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot