N-[(2S,3R,4R,5S,6R)-4-[(2R,3R,4S,5R,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-Methoxyoxan-2-Yl]Oxy-5-Hydroxy-6-(Hydroxymethyl)-2-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Methyloxan-2-Yl]Oxyoxan-3-Yl]Acetamide
[CAS# 130648-54-3]

Identification

• Name: N-[(2S,3R,4R,5S,6R)-4-[(2R,3R,4S,5R,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-Methoxyoxan-2-Yl]Oxy-5-Hydroxy-6-(Hydroxymethyl)-2-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Methyloxan-2-Yl]Oxyoxan-3-Yl]Acetamide
• Synonyms: N-[(2S,3R,4R,5S,6R)-4-[(2R,3R,4S,5R,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-Methoxy-Tetrahydropyran-2-Yl]Oxy-5-Hydroxy-6-(Hydroxymethyl)-2-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Methyl-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-3-Yl]Acetamide; N-[(2S,3R,4R,5S,6R)-4-[[(2R,3R,4S,5R,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-Methoxy-2-Tetrahydropyranyl]Oxy]-5-Hydroxy-6-(Hydroxymethyl)-2-[[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Methyl-2-Tetrahydropyranyl]Oxy]-3-Tetrahydropyranyl]Acetamide; N-[(2S,3R,4R,5S,6R)-4-[(2R,3R,4S,5R,6R)-4,5-Dihydroxy-3-Methoxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-5-Hydroxy-6-Methylol-2-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-2-Methyl-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-3-Yl]Acetamide
• Molecular Formula: C₂₂H₃₉NO₁₆
• Molecular Weight: 573.55
• CAS Registry Number: 130648-54-3
• SMILES: [C@@]3(O[C@H]2[C@@H]([C@@H](O[C@H]1[C@H](OC)[C@@H](O)[C@@H](O)[C@H](O1)CO)[C@H](O)[C@H](O2)CO)NC(=O)C)([C@H](O)[C@@H](O)[C@@H](O)[C@H](O3)CO)C
• InChI: 1S/C22H39NO16/c1-7(27)23-11-17(37-21-18(34-3)15(31)12(28)8(4-24)36-21)14(30)9(5-25)35-20(11)39-22(2)19(33)16(32)13(29)10(6-26)38-22/h8-21,24-26,28-33H,4-6H2,1-3H3,(H,23,27)/t8-,9-,10-,11-,12+,13+,14-,15+,16+,17-,18-,19-,20+,21+,22+/m1/s1
• InChIKey: CYGRWYYLBVCKBG-YNZJLEQLSA-N

Properties

• Density: 1.6g/cm³ (Cal.)
• Boiling point: 912.645°C at 760 mmHg (Cal.)
• Flash point: 505.75°C (Cal.)