Aceneuramic Acid
[CAS# 6918-20-3]

Identification

• Name: Aceneuramic Acid
• Synonyms: (2S,4S,5R,6R)-5-Acetamido-2,4-Dihydroxy-6-(1,2,3-Trihydroxypropyl)Tetrahydropyran-2-Carboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2,4-Dihydroxy-6-(1,2,3-Trihydroxypropyl)-2-Tetrahydropyrancarboxylic Acid; Acide Aceneuramique [Inn-French]
• Molecular Formula: C₁₁H₁₉NO₉
• Molecular Weight: 309.27
• CAS Registry Number: 6918-20-3
• SMILES: [C@@H]1([C@@H]([C@H](C[C@](O1)(C(O)=O)O)O)NC(C)=O)C(C(CO)O)O
• InChI: 1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/t5-,6?,7+,8?,9+,11-/m0/s1
• InChIKey: SQVRNKJHWKZAKO-GSQQXRCOSA-N

Properties

• Density: 1.645g/cm³ (Cal.)
• Boiling point: 805.017°C at 760 mmHg (Cal.)
• Flash point: 440.659°C (Cal.)