8-(methoxycarbonyl)octyl 3-O-<2-O-(2,3,4,6-tetra-O-acetyl-α-D-mannopyranosyl)-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-6-O-<2-O-<2,3,4-tri-O-acetyl-6-O-(diphenylphosphoryl)-α-D-mannopyranosyl>-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-2,4-di-O-benzyl-α- | 108167-29-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 8-(methoxycarbonyl)octyl 3-O-<2-O-(2,3,4,6-tetra-O-acetyl-α-D-mannopyranosyl)-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-6-O-<2-O-<2,3,4-tri-O-acetyl-6-O-(diphenylphosphoryl)-α-D-mannopyranosyl>-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-2,4-di-O-benzyl-α-
• 英文别名: 8-(methoxycarbonyl)octyl 3-O-[2-O-(2,3,4,6-tetra-O-acetyl-α-D-mannopyranosyl)-3,4,6-tri-O-benzyl-α-D-mannopyranosyl]-6-O-{2-O-[2,3,4-tri-O-acetyl-6-O-(diphenylphosphoryl)-α-D-mannopyranosyl]-3,4,6-tri-O-benzyl-α-D-mannopyranosyl}-2,4-di-O-benzyl-α-；methyl 9-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5R,6R)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-3-[(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[[(2S,3S,4S,5R,6R)-4,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-3-[(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-(diphenoxyphosphoryloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,5-bis(phenylmethoxy)oxan-2-yl]oxynonanoate
• CAS: 108167-29-9
• 化学式: C₁₂₂H₁₄₁O₃₈P
• 分子量: 2246.41
• InChiKey: BSIVOZZIOYYDIA-VDJGSKRCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  15.2
• 重原子数：
  161
• 可旋转键数：
  68
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  421
• 氢给体数：
  0
• 氢受体数：
  38

反应信息

• 作为反应物：
  描述：

  8-(methoxycarbonyl)octyl 3-O-<2-O-(2,3,4,6-tetra-O-acetyl-α-D-mannopyranosyl)-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-6-O-<2-O-<2,3,4-tri-O-acetyl-6-O-(diphenylphosphoryl)-α-D-mannopyranosyl>-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-2,4-di-O-benzyl-α- 生成 8-(methoxycarbonyl)octyl 3-O-<2-O-(α-D-mannopyranosyl)-α-D-mannopyranosyl>-6-O-<2-O-(α-D-mannopyranosyl 6-disodium phosphate)-α-D-mannopyranosyl>-α-D-mannopyranoside
  参考文献：
  名称：

  Synthesis of phosphorylated pentasaccharides found on asparagine-linked carbohydrate chains of lysosomal enzymes

  摘要：

  DOI：

  10.1021/jo00389a039
• 作为产物：
  描述：

  8-(methoxycarbonyl)octyl 6-O-<2-O-<2,3,4-tri-O-acetyl-6-O-(diphenylphosphoryl)-α-D-mannopyranosyl>-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-2,4-di-O-benzyl-3-O-(3,4,6-tri-O-benzyl-α-D-mannopyranosyl)-α-D-mannopyranoside 、 2,3,4,6-四-O-乙酰基-1-溴-Alpha-D-甘露糖 在 silver trifluoromethanesulfonate 、 1,1,3,3-四甲基脲 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 144.0h， 以71%的产率得到8-(methoxycarbonyl)octyl 3-O-<2-O-(2,3,4,6-tetra-O-acetyl-α-D-mannopyranosyl)-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-6-O-<2-O-<2,3,4-tri-O-acetyl-6-O-(diphenylphosphoryl)-α-D-mannopyranosyl>-3,4,6-tri-O-benzyl-α-D-mannopyranosyl>-2,4-di-O-benzyl-α-
  参考文献：
  名称：

  Synthesis of phosphorylated pentasaccharides found on asparagine-linked carbohydrate chains of lysosomal enzymes

  摘要：

  DOI：

  10.1021/jo00389a039