Ligand name: (3alpha,7alpha)-3,7,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one
PDB ligand accession: B2S
DrugBank: n/a
PubChem: 13456578
ChEMBL: n/a
InChI Key: LINOMUASTDIRTM-BGQOOYBISA-N
SMILES: CC1=CC2C(C(C1=O)O)(C3(CC(C(C34CO4)O2)O)C)CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Prenol lipids
      • Subclass: Sesquiterpenoids

List of PDB structures and/or AlphaFold models with target protein Q9HDE2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3B2S	Download	Experimental	e3b2sA1 e3b2sA2	CoA-dependent acyltransferases CoA-dependent acyltransferases	LigPlot