Ligand name: OCTANAL
PDB ligand accession: OYA
DrugBank: n/a
PubChem: 454
ChEMBL: CHEMBL18407
InChI Key: NUJGJRNETVAIRJ-UHFFFAOYSA-N
SMILES: CCCCCCCC=O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

List of PDB structures and/or AlphaFold models with target protein Q5SLQ3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2QHU	Download	Experimental	e2qhuA1	Class II aaRS and biotin synthetases	LigPlot