Ligand name: [(2R,5R,11R,14S,24E)-14-[(acetyloxy)methyl]-8-{[5-(3,5-dimethyl-1H-pyrrol-2-yl-kappaN)-5-(3,5-dimethyl-2H-pyrrol-2-ylidene-kappaN)pentanoyl]oxy}-5,11-dihydroxy-2-{[(9E)-octadec-9-enoyl]oxy}-5,11,16-trioxo-4,6,10,12,15-pentaoxa-5lambda~5~,11lambda~5~-diphosphatritriacont-24-en-1-yl (9E)-octadec-9-enoatato](difluoro)boron
PDB ligand accession: C9V
DrugBank: n/a
PubChem: 137349073
ChEMBL: n/a
InChI Key: GDYLGRNGCDWDQL-UUEIIFSHSA-N
SMILES: [B-]1(n2c(cc(c2C(=C3[N+]1=C(C=C3C)C)CCCC(=O)OC(COP(=O)(O)OCC(COC(=O)C)OC(=O)CCCCCCCC=CCCCCCCCC)COP(=O)(O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC)C)C)(F)F

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Pentacarboxylic acids and derivatives

List of proteins that are targets for C9V

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P69681_C9V	P69681	n/a