| 175289-39-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 175289-39-1
• 化学式: C₃₈H₅₄N₆O₂₂
• 分子量: 946.874
• InChiKey: SMPAEYFNYMQJOM-BMJLMUNWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.83
• 重原子数：
  66.0
• 可旋转键数：
  18.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  366.31
• 氢给体数：
  3.0
• 氢受体数：
  23.0

反应信息

• 作为反应物：
  描述：

  在 platinum(IV) oxide 氢气 作用下， 以 乙醇 、 氯仿 为溶剂， 反应 5.0h， 以62%的产率得到
  参考文献：
  名称：

  Synthesis ofl-Histidine and (-)-Spinacine Chitooligosyl Amides¹

  摘要：

  The synthesis of N-(2-acetamido-4-O-[2-acetamido-4-O-{2-acetamido-2-deoxy- beta-D-glucopyranosyl}-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-beta-D-glucopyranosyl)-L-histidine amide (3), N-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-(6S)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic amide (4) and N-(2-acetamido-4-O-[2-acetamido-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-beta-D-glucopyranosyl)-(6S)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxamide (5) is achieved via coupling of the appropiate glycosylamines with Boc-protected L-histidine or with (6S)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic acid ((-)-spinacine), respectively, by means of EEDQ and subsequent deprotection.

  DOI：

  10.1080/07328309608005424
• 作为产物：
  描述：

  (2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-β-D-glucopyranosyl)-(1→4)-(2-acetamido-3,6-di-O-acetyl-2-deoxy-β-D-glucopyranosyl)-(1→4)-2-acetamido-1,3,6-tri-O-acetyl-2-deoxy-α-D-glucopyranose 在 盐酸 、 tetramethyl guanidinium azide 作用下， 以 二氯甲烷 为溶剂， 反应 48.5h， 生成
  参考文献：
  名称：

  Synthesis ofl-Histidine and (-)-Spinacine Chitooligosyl Amides¹

  摘要：

  The synthesis of N-(2-acetamido-4-O-[2-acetamido-4-O-{2-acetamido-2-deoxy- beta-D-glucopyranosyl}-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-beta-D-glucopyranosyl)-L-histidine amide (3), N-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-(6S)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic amide (4) and N-(2-acetamido-4-O-[2-acetamido-2-deoxy-beta-D-glucopyranosyl]-2-deoxy-beta-D-glucopyranosyl)-(6S)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxamide (5) is achieved via coupling of the appropiate glycosylamines with Boc-protected L-histidine or with (6S)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine-6-carboxylic acid ((-)-spinacine), respectively, by means of EEDQ and subsequent deprotection.

  DOI：

  10.1080/07328309608005424