Ligand name: Secologanin
PDB ligand accession: SCG
DrugBank: n/a
PubChem: 161276
ChEMBL: CHEMBL1235867
InChI Key: CSKKDSFETGLMSB-NRZPKYKESA-N
SMILES: COC(=O)C1=COC(C(C1CC=O)C=C)OC2C(C(C(C(O2)CO)O)O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9SPP9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3U5Y	Download	Experimental	e3u5yA1 e3u5yB1	TIM beta/alpha-barrel TIM beta/alpha-barrel	LigPlot