(2S,3S,4R,5R)-2,4,5-Trihydroxy-3-[(2S)-1-Hydroxy-1-Oxopropan-2-Yl]Oxy-6-Oxohexanoic Acid
[CAS# 75195-61-8]

Identification

• Name: (2S,3S,4R,5R)-2,4,5-Trihydroxy-3-[(2S)-1-Hydroxy-1-Oxopropan-2-Yl]Oxy-6-Oxohexanoic Acid
• Synonyms: (2S,3S,4R,5R)-2,4,5-Trihydroxy-3-[(1S)-2-Hydroxy-1-Methyl-2-Oxo-Ethoxy]-6-Oxo-Hexanoic Acid; (2S,3S,4R,5R)-2,4,5-Trihydroxy-3-[(1S)-2-Hydroxy-1-Methyl-2-Oxoethoxy]-6-Oxohexanoic Acid; (2S,3S,4R,5R)-2,4,5-Trihydroxy-3-[(1S)-2-Hydroxy-2-Keto-1-Methyl-Ethoxy]-6-Keto-Hexanoic Acid
• Molecular Formula: C₉H₁₄O₉
• Molecular Weight: 266.20
• CAS Registry Number: 75195-61-8
• SMILES: [C@@H](C=O)(O)[C@@H](O)[C@H](O[C@@H](C)C(=O)O)[C@H](O)C(=O)O
• InChI: 1S/C9H14O9/c1-3(8(14)15)18-7(6(13)9(16)17)5(12)4(11)2-10/h2-7,11-13H,1H3,(H,14,15)(H,16,17)/t3-,4-,5+,6-,7-/m0/s1
• InChIKey: DSSRPHTYSGHGMY-ZYNSJIGGSA-N

Properties

• Density: 1.619g/cm³ (Cal.)
• Boiling point: 652.803°C at 760 mmHg (Cal.)
• Flash point: 257.134°C (Cal.)