(2S,3S,4S,5R,6S)-6-[4-(Dipropylsulfamoyl)benzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
[CAS# 34017-15-7]

Identification

• Name: (2S,3S,4S,5R,6S)-6-[4-(Dipropylsulfamoyl)benzoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
• Synonyms: (2S,3S,4S,5R,6S)-6-[4-(Dipropylsulfamoyl)Benzoyl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6S)-6-[[4-(Dipropylsulfamoyl)Phenyl]-Oxomethoxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6S)-6-[4-(Dipropylsulfamoyl)Phenyl]Carbonyloxy-3,4,5-Trihydroxy-Oxane-2-Carboxylic Acid
• Molecular Formula: C₁₉H₂₇NO₁₀S
• Molecular Weight: 461.48
• CAS Registry Number: 34017-15-7
• SMILES: [C@@H]1([C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)OC(C2=CC=C(C=C2)[S](=O)(=O)N(CCC)CCC)=O
• InChI: 1S/C19H27NO10S/c1-3-9-20(10-4-2)31(27,28)12-7-5-11(6-8-12)18(26)30-19-15(23)13(21)14(22)16(29-19)17(24)25/h5-8,13-16,19,21-23H,3-4,9-10H2,1-2H3,(H,24,25)/t13-,14-,15+,16-,19-/m0/s1
• InChIKey: BZOGRYWIYJNLDE-NAHJCDBISA-N

Properties

• Density: 1.5g/cm³ (Cal.)
• Boiling point: 688.259°C at 760 mmHg (Cal.)
• Flash point: 370.046°C (Cal.)