N-[(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R)-2-Acetamido-4,5,6-Trihydroxy-1-Oxohexan-3-Yl]Oxy-3,5-Dihydroxy-6-Methyloxan-4-Yl]Acetamide
[CAS# 126247-65-2]

Identification

• Name: N-[(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R)-2-Acetamido-4,5,6-Trihydroxy-1-Oxohexan-3-Yl]Oxy-3,5-Dihydroxy-6-Methyloxan-4-Yl]Acetamide
• Synonyms: N-[(2S,3R,4S,5S,6R)-2-[(1R,2S,3R)-1-[(1R)-1-Acetamido-2-Oxo-Ethyl]-2,3,4-Trihydroxy-Butoxy]-3,5-Dihydroxy-6-Methyl-Tetrahydropyran-4-Yl]Acetamide; N-[(2S,3R,4S,5S,6R)-2-[(1R,2S,3R)-1-[(1R)-1-Acetamido-2-Oxoethyl]-2,3,4-Trihydroxybutoxy]-3,5-Dihydroxy-6-Methyl-4-Tetrahydropyranyl]Acetamide; N-[(2S,3R,4S,5S,6R)-2-[(1R,2S,3R)-1-[(1R)-1-Acetamido-2-Keto-Ethyl]-2,3,4-Trihydroxy-Butoxy]-3,5-Dihydroxy-6-Methyl-Tetrahydropyran-4-Yl]Acetamide
• Molecular Formula: C₁₆H₂₈N₂O₁₀
• Molecular Weight: 408.40
• CAS Registry Number: 126247-65-2
• SMILES: [C@H](C=O)([C@@H](O[C@H]1[C@H](O)[C@H]([C@H](O)[C@H](O1)C)NC(=O)C)[C@@H](O)[C@H](O)CO)NC(=O)C
• InChI: 1S/C16H28N2O10/c1-6-12(24)11(18-8(3)22)14(26)16(27-6)28-15(13(25)10(23)5-20)9(4-19)17-7(2)21/h4,6,9-16,20,23-26H,5H2,1-3H3,(H,17,21)(H,18,22)/t6-,9+,10-,11+,12-,13+,14-,15-,16+/m1/s1
• InChIKey: CJWXCNXHAIFFMH-AVZHFPDBSA-N

Properties

• Density: 1.436g/cm³ (Cal.)
• Boiling point: 866.263°C at 760 mmHg (Cal.)
• Flash point: 477.699°C (Cal.)