Ligand name: 6,7,8,9-TETRAHYDRO-4-HYDROXY-3-(1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN-2-ONE
PDB ligand accession: NIU
DrugBank: DB08274
PubChem: 54708746
ChEMBL: n/a
InChI Key: YKJXQZGJGDTEOC-AWEZNQCLSA-N
SMILES: CCC(c1ccccc1)C2=C(C3=C(CCCCC3)OC2=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Cycloheptapyrans
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P04584

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6UPJ	Download	Experimental	e6upjB1 e6upjA1	cradle loop barrel cradle loop barrel	LigPlot