Ligand name: 2,3,5-trimethyl-6-propyl-7H-furo[3,2-g][1]benzopyran-7-one
PDB ligand accession: 6ZE
DrugBank: n/a
PubChem: 3586132
ChEMBL: CHEMBL4099822
InChI Key: ADGUVFJYVNRVPX-UHFFFAOYSA-N
SMILES: CCCC1=C(c2cc3c(c(oc3cc2OC1=O)C)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Coumarins and derivatives
      • Subclass: Furanocoumarins

List of PDB structures and/or AlphaFold models with target protein P05091

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5L13	Download	Experimental	e5l13A1 e5l13A2 e5l13B1 e5l13B2 e5l13C1 e5l13C2 e5l13D1 e5l13D2 e5l13E1 e5l13E2 e5l13F1 e5l13F2 e5l13G1 e5l13G2 e5l13H1 e5l13H2	ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot