N-Acetyl-7-Deoxyneuraminic Acid
[CAS# 117193-31-4]

Identification

• Name: N-Acetyl-7-Deoxyneuraminic Acid
• Synonyms: (2S,4S,5R,6S)-5-Acetamido-6-[(2S)-2,3-Dihydroxypropyl]-2,4-Dihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,4S,5R,6S)-5-Acetamido-6-[(2S)-2,3-Dihydroxypropyl]-2,4-Dihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,4S,5R,6S)-5-Acetamido-6-Glyceryl-2,4-Dihydroxy-Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₁₁H₁₉NO₈
• Molecular Weight: 293.27
• CAS Registry Number: 117193-31-4
• SMILES: [C@@H]1(C[C@](O[C@H]([C@@H]1NC(=O)C)C[C@@H](CO)O)(C(O)=O)O)O
• InChI: 1S/C11H19NO8/c1-5(14)12-9-7(16)3-11(19,10(17)18)20-8(9)2-6(15)4-13/h6-9,13,15-16,19H,2-4H2,1H3,(H,12,14)(H,17,18)/t6-,7-,8-,9+,11-/m0/s1
• InChIKey: OJKMRYAMSZNUHX-HQCZOREISA-N

Properties

• Density: 1.543g/cm³ (Cal.)
• Boiling point: 737.178°C at 760 mmHg (Cal.)
• Flash point: 399.631°C (Cal.)