Ligand name: 4-[(3R,3aS,6R,6aS)-6-(3-methoxy-4-oxidanyl-phenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxy-phenol
PDB ligand accession: GEF
DrugBank: n/a
PubChem: 12309636
ChEMBL: CHEMBL267963
InChI Key: HGXBRUKMWQGOIE-NSMLZSOPSA-N
SMILES: COc1cc(ccc1O)C2C3COC(C3CO2)c4ccc(c(c4)OC)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lignans, neolignans and related compounds
    • Class: Furanoid lignans
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein I6LRS1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7CS5	Download	Experimental	e7cs5E1 e7cs5A1 e7cs5B1 e7cs5F1 e7cs5D1 e7cs5C1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot