Ligand name: 1-[2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,6-bis(oxidanyl)phenyl]-3-(4-hydroxyphenyl)propan-1-one
PDB ligand accession: LN9
DrugBank: DB16771
PubChem: 6072
ChEMBL: CHEMBL245067
InChI Key: IOUVKUPGCMBWBT-QNDFHXLGSA-N
SMILES: c1cc(ccc1CCC(=O)c2c(cc(cc2OC3C(C(C(C(O3)CO)O)O)O)O)O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P31639

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8HIN	Download	Experimental	e8hinA1	Sodium:neurotransmitter symporter family (SNF)-like	LigPlot