3'-Sialyllactose
[CAS# 35890-38-1]

Identification

• Classification: Biochemical >> Carbohydrate >> Double sugar
• Name: 3'-Sialyllactose
• Synonyms: (2S,4S,5R,6R)-5-Acetamido-2-[(2S,3R,4S,5S,6R)-2-[(1R,2R,3R)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Oxo-Butoxy]-3,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-4-Yl]Oxy-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Tetrahydropyran-2-Carboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2-[[(2S,3R,4S,5S,6R)-2-[(1R,2R,3R)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Oxobutoxy]-3,5-Dihydroxy-6-(Hydroxymethyl)-4-Tetrahydropyranyl]Oxy]-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]-2-Tetrahydropyrancarboxylic Acid; (2S,4S,5R,6R)-5-Acetamido-2-[(2S,3R,4S,5S,6R)-2-[(1R,2R,3R)-1-[(1R)-1,2-Dihydroxyethyl]-2,3-Dihydroxy-4-Keto-Butoxy]-3,5-Dihydroxy-6-Methylol-Tetrahydropyran-4-Yl]Oxy-4-Hydroxy-6-[(1R,2R)-1,2,3-Trihydroxypropyl]Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₂₃H₃₉NO₁₉
• Molecular Weight: 633.56
• CAS Registry Number: 35890-38-1
• SMILES: [C@]1(O[C@@H]([C@@H]([C@H](O)CO)O)[C@@H]([C@H](C1)O)NC(=O)C)(O[C@@H]2[C@H]([C@H](O[C@@H]([C@@H]([C@H](C=O)O)O)[C@H](O)CO)O[C@@H]([C@@H]2O)CO)O)C(=O)O
• InChI: 1S/C23H39NO19/c1-7(29)24-13-8(30)2-23(22(38)39,42-19(13)15(35)10(32)4-26)43-20-16(36)12(6-28)40-21(17(20)37)41-18(11(33)5-27)14(34)9(31)3-25/h3,8-21,26-28,30-37H,2,4-6H2,1H3,(H,24,29)(H,38,39)/t8-,9-,10+,11+,12+,13+,14+,15+,16-,17+,18+,19+,20-,21-,23-/m0/s1
• InChIKey: OIZGSVFYNBZVIK-FHHHURIISA-N

Properties

• Density: 1.728g/cm³ (Cal.)
• Boiling point: 1132.804°C at 760 mmHg (Cal.)
• Flash point: 638.897°C (Cal.)