Ligand name: (2~{R},3~{R},4~{R},5~{S})-1-[5-[[4-(3,4-dihydro-2~{H}-1,5-benzodioxepin-7-yl)phenyl]methoxy]pentyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
PDB ligand accession: KG5
DrugBank: n/a
PubChem: 118719915
ChEMBL: CHEMBL3354056
InChI Key: FGUXCOMLHUOVQN-QGNCETNGSA-N
SMILES: c1cc(ccc1COCCCCCN2CC(C(C(C2CO)O)O)O)c3ccc4c(c3)OCCCO4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzylethers

List of PDB structures and/or AlphaFold models with target protein Q24451

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6RRW	Download	Experimental	e6rrwA3 e6rrwA4 e6rrwA5	Glycosyl hydrolase domain-like immunoglobulin/albumin-binding domain-like TIM beta/alpha-barrel	LigPlot