(2S,3S,4R)-3-(Carboxymethyl)-4-[N-[2-(Carboxymethylamino)-2-Oxoethoxy]-C-Methylcarbonimidoyl]Pyrrolidine-2-Carboxylic Acid
[CAS# 119320-06-8]

Identification

• Name: (2S,3S,4R)-3-(Carboxymethyl)-4-[N-[2-(Carboxymethylamino)-2-Oxoethoxy]-C-Methylcarbonimidoyl]Pyrrolidine-2-Carboxylic Acid
• Synonyms: (2S,3S,4R)-3-(Carboxymethyl)-4-[N-[2-(Carboxymethylamino)-2-Oxo-Ethoxy]-C-Methyl-Carbonimidoyl]Pyrrolidine-2-Carboxylic Acid; (2S,3S,4R)-3-(Carboxymethyl)-4-[(1E)-1-[2-(Carboxymethylamino)-2-Oxoethoxy]Iminoethyl]-2-Pyrrolidinecarboxylic Acid; (2S,3S,4R)-3-(Carboxymethyl)-4-[N-[2-(Carboxymethylamino)-2-Keto-Ethoxy]-C-Methyl-Carbonimidoyl]Proline
• Molecular Formula: C₁₃H₁₉N₃O₈
• Molecular Weight: 345.31
• CAS Registry Number: 119320-06-8
• SMILES: [C@@H]1([C@@H](/C(=N/OCC(=O)NCC(=O)O)C)CN[C@@H]1C(=O)O)CC(=O)O
• InChI: 1S/C13H19N3O8/c1-6(16-24-5-9(17)14-4-11(20)21)8-3-15-12(13(22)23)7(8)2-10(18)19/h7-8,12,15H,2-5H2,1H3,(H,14,17)(H,18,19)(H,20,21)(H,22,23)/b16-6+/t7-,8+,12-/m0/s1
• InChIKey: QBIKARYQTKNDPS-MUTADSMTSA-N

Properties

• Density: 1.613g/cm³ (Cal.)