Product Name
Bivalirudin TFA Salt
Certificate of Analysis (COA)
IUPAC Name
(2S)-2-(2S)-2-(2S)-2-(2S)-2-(2S)-1-(2S,3S)-2-(2S)-2-(2S)-2-(2S)-2-(2S)-2-2-(2S)-4-amino-2-2-2-2-2-(2S)-1-(2S)-2-(2S)-1-(2R)-2-amino-3-phenylpropanoylpyrrolidine-2-carbonylamino-5-carbamimidamidopentanoylpyrrolidine-2-carbonylaminoacetylaminoacetylaminoacetylaminoacetylamino-4-oxobutanoylaminoacetylamino-3-carboxypropanoylamino-3-phenylpropanoylamino-4-carboxybutanoylamino-4-carboxybutanoylamino-3-methylpentanoylpyrrolidine-2-carbonylamino-4-carboxybutanoylamino-4-carboxybutanoylamino-3-(4-hydroxyphenyl)propanoylamino-4-methylpentanoic acid
InChI Key
OIRCOABEOLEUMC-GEJPAHFPSA-N
SMILES
CCC@H(C)C@@H(C(=O)N1CCCC@H1C(=O)NC@@H(CCC(=O)O)C(=O)NC@@H(CCC(=O)O)C(=O)NC@@H(CC2=CC=C(C=C2)O)C(=O)NC@@H(CC(C)C)C(=O)O)NC(=O)C@H(CCC(=O)O)NC(=O)C@H(CCC(=O)O)NC(=O)C@H(CC3=CC=CC=C3)NC(=O)C@H(CC(=O)O)NC(=O)CNC(=O)C@H(CC(=O)N)NC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(=O)C@@H4CCCN4C(=O)C@H(CCCNC(=N)N)NC(=O)C@@H5CCCN5C(=O)C@@H(CC6=CC=CC=C6)N