Ligand name: N-[(1S,2R,3R,4S,5R)-3,4,5-trihydroxy-2-methylcyclohexyl]benzamide
PDB ligand accession: 3U2
DrugBank: n/a
PubChem: 137348171
ChEMBL: n/a
InChI Key: LSIKOCGDCMQNSQ-GIVNFFOOSA-N
SMILES: CC1C(CC(C(C1O)O)O)NC(=O)c2ccccc2
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q8A3I4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4WSK	Download	Experimental	e4wskA2 e4wskB2 e4wskC2	TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot