(4R,5R,6R)-5-Acetamido-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-5,6-Dihydro-4H-Pyran-2-Carboxylic Acid
[CAS# 79026-37-2]

Identification

• Name: (4R,5R,6R)-5-Acetamido-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-5,6-Dihydro-4H-Pyran-2-Carboxylic Acid
• Synonyms: 2,3-Dehydro-4-Epi-N-Acetylneuraminic Acid; D-Glycero-D-Talo-Non-2-Enonic Acid, 5-(Acetylamino)-2,6-Anhydro-3,5-Dideoxy-; Dheana
• Molecular Formula: C₁₁H₁₇NO₈
• Molecular Weight: 291.26
• CAS Registry Number: 79026-37-2
• SMILES: [C@H]1(OC(=C[C@@H](O)[C@H]1NC(=O)C)C(=O)O)[C@H](O)[C@H](O)CO
• InChI: 1S/C11H17NO8/c1-4(14)12-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-13/h2,5-6,8-10,13,15-17H,3H2,1H3,(H,12,14)(H,18,19)/t5-,6-,8-,9-,10-/m1/s1
• InChIKey: JINJZWSZQKHCIP-PKGQWCBFSA-N

Properties

• Density: 1.588g/cm³ (Cal.)
• Boiling point: 773.428°C at 760 mmHg (Cal.)
• Flash point: 421.554°C (Cal.)