(2S)-5-Oxo-1-[(2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexyl]Pyrrolidine-2-Carboxylic Acid
[CAS# 74474-75-2]

Identification

• Name: (2S)-5-Oxo-1-[(2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexyl]Pyrrolidine-2-Carboxylic Acid
• Synonyms: (2S)-5-Oxo-1-[(2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexyl]-2-Pyrrolidinecarboxylic Acid; (2S)-5-Keto-1-[(2R,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexyl]Proline; 1-(1-Deoxy-D-Mannitol-1-Yl)-5-Oxo-L-Proline
• Molecular Formula: C₁₁H₁₉NO₈
• Molecular Weight: 293.27
• CAS Registry Number: 74474-75-2
• SMILES: [C@H]1(C(=O)O)N(C(CC1)=O)C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
• InChI: 1S/C11H19NO8/c13-4-7(15)10(18)9(17)6(14)3-12-5(11(19)20)1-2-8(12)16/h5-7,9-10,13-15,17-18H,1-4H2,(H,19,20)/t5-,6+,7+,9+,10+/m0/s1
• InChIKey: JSDKIRAEXWDIPM-SZWOQXJISA-N

Properties

• Density: 1.619g/cm³ (Cal.)
• Boiling point: 756.785°C at 760 mmHg (Cal.)
• Flash point: 411.489°C (Cal.)