Ligand name: 3alpha-[(3-carboxy-3-methylbutanoyl)oxy]-8alpha,9beta,10alpha,13alpha,17alpha,19beta-lup-20(29)-en-28-oic acid
PDB ligand accession: 2I4
DrugBank: DB06581
PubChem: 457928
ChEMBL: CHEMBL404519
InChI Key: YJEJKUQEXFSVCJ-WRFMNRASSA-N
SMILES: CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)OC(=O)CC(C)(C)C(=O)O)C)C(=O)O

ClassyFire chemical classification:

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

List of proteins that are targets for 2I4

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	Q72497_2I4	Q72497	n/a