methyl 3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-β-D-glucopyranosyl-(1->6)-2,3-di-O-benzoyl-α-D-mannopyranosyl-(1->6)-2,3,4-tri-O-benzoyl-α-D-mannopyranoside | 618106-71-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: methyl 3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-β-D-glucopyranosyl-(1->6)-2,3-di-O-benzoyl-α-D-mannopyranosyl-(1->6)-2,3,4-tri-O-benzoyl-α-D-mannopyranoside
• 英文别名: [(2R,3R,4S,5S,6S)-4,5-dibenzoyloxy-2-[[(2S,3S,4S,5R,6R)-3,4-dibenzoyloxy-6-[[(2R,3R,4R,5S,6R)-4,5-diacetyloxy-6-(acetyloxymethyl)-3-(1,3-dioxoisoindol-2-yl)oxan-2-yl]oxymethyl]-5-hydroxyoxan-2-yl]oxymethyl]-6-methoxyoxan-3-yl] benzoate
• CAS: 618106-71-1
• 化学式: C₆₈H₆₃NO₂₅
• 分子量: 1294.24
• InChiKey: ZSNYPBFEDSSZCO-PJUMWZAPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.3
• 重原子数：
  94
• 可旋转键数：
  30
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  323
• 氢给体数：
  1
• 氢受体数：
  25

反应信息

• 作为反应物：
  描述：

  methyl 3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-β-D-glucopyranosyl-(1->6)-2,3-di-O-benzoyl-α-D-mannopyranosyl-(1->6)-2,3,4-tri-O-benzoyl-α-D-mannopyranoside 在 吡啶 、 甲醇 、 氨 、 一水合肼 作用下， 以 乙醇 为溶剂， 反应 168.0h， 生成 methyl 2-acetamido-2-deoxy-β-D-glucopyranosyl-(1->6)-α-D-mannopyranosyl-(1->6)-α-D-mannopyranoside
  参考文献：
  名称：

  Concise syntheses of β-GlcNAcp-(1→6)-α-Manp-(1→6)-Manp and its dimer, and β-GlcNAcp-(1→2)-α-Manp-(1→6)-Manp

  摘要：

  beta-D-GlcNAcp-(1-->6)-alpha-D-Manp-(1-->6)-D-Manp and beta-D-GlcNAcp-(1-->2)-alpha-D-Manp-(1-->6)-D-Manp were synthesized as their methyl glycosides in a regio- and stereoselective way, whereas an ethylene glycol-coupled dimer of the former was prepared in a convergent manner. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/s0957-4166(03)00570-6
• 作为产物：
  描述：

  在 吡啶 、 甲醇 、 三氟甲磺酸三甲基硅酯 、 氨 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 、 乙酰氯 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 7.0h， 生成 methyl 3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-β-D-glucopyranosyl-(1->6)-2,3-di-O-benzoyl-α-D-mannopyranosyl-(1->6)-2,3,4-tri-O-benzoyl-α-D-mannopyranoside
  参考文献：
  名称：

  Concise syntheses of β-GlcNAcp-(1→6)-α-Manp-(1→6)-Manp and its dimer, and β-GlcNAcp-(1→2)-α-Manp-(1→6)-Manp

  摘要：

  beta-D-GlcNAcp-(1-->6)-alpha-D-Manp-(1-->6)-D-Manp and beta-D-GlcNAcp-(1-->2)-alpha-D-Manp-(1-->6)-D-Manp were synthesized as their methyl glycosides in a regio- and stereoselective way, whereas an ethylene glycol-coupled dimer of the former was prepared in a convergent manner. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/s0957-4166(03)00570-6