Ligand name: 3,6,9,12,15,18,21,24,27,30,33,36,39-TRIDECAOXAHENTETRACONTANE-1,41-DIOL
PDB ligand accession: PE3
DrugBank: n/a
PubChem: 656926
ChEMBL: n/a
InChI Key: ILLKMACMBHTSHP-UHFFFAOYSA-N
SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein E8T502

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4UOV	Download	Experimental	e4uovA1 e4uovB1 e4uovF1	Carbonic anhydrase Carbonic anhydrase Carbonic anhydrase	LigPlot