(2S,3R,4S,5R)-2,3,5-Trihydroxy-6-Oxo-4-Sulfooxyhexanoic Acid
[CAS# 110231-93-1]

Identification

• Name: (2S,3R,4S,5R)-2,3,5-Trihydroxy-6-Oxo-4-Sulfooxyhexanoic Acid
• Synonyms: (2S,3R,4S,5R)-2,3,5-Trihydroxy-6-Oxo-4-Sulfooxy-Hexanoic Acid; (2S,3R,4S,5R)-2,3,5-Trihydroxy-6-Keto-4-Sulfoxy-Hexanoic Acid; 3-Sulfoglucuronic Acid
• Molecular Formula: C₆H₁₀O₁₀S
• Molecular Weight: 274.20
• CAS Registry Number: 110231-93-1
• SMILES: [C@@H](C=O)(O)[C@H]([C@H](O)[C@H](O)C(=O)O)O[S](=O)(=O)O
• InChI: 1S/C6H10O10S/c7-1-2(8)5(16-17(13,14)15)3(9)4(10)6(11)12/h1-5,8-10H,(H,11,12)(H,13,14,15)/t2-,3+,4-,5+/m0/s1
• InChIKey: DLJXFFATZRGSBR-SKNVOMKLSA-N

Properties

• Density: 1.981g/cm³ (Cal.)