Ligand name: COA-S-TRIMETHYLENE-ACETYL-TRYPTAMINE
PDB ligand accession: CA3
DrugBank: DB01777
PubChem: 446814
ChEMBL: n/a
InChI Key: RFOXOYXMKJPZDH-VTINEICCSA-N
SMILES: CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSCCCCC(=O)NCCc4c[nH]c5c4cccc5)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: S-alkyl-CoAs
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q29495

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1KUX	Download	Experimental	e1kuxA1	Nat/Ivy	LigPlot