(R)-4-benzyl-3-((2R,3S,5S)-5,7-bis((tert-butyldimethylsilyl)oxy)-3-methoxy-2-methylheptanoyl)oxazolidin-2-one | 1361130-12-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: (R)-4-benzyl-3-((2R,3S,5S)-5,7-bis((tert-butyldimethylsilyl)oxy)-3-methoxy-2-methylheptanoyl)oxazolidin-2-one
• CAS: 1361130-12-2
• 化学式: C₃₁H₅₅NO₆Si₂
• 分子量: 593.952
• InChiKey: JFRTYMPORTYYLO-ZDEZRRDYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.42
• 重原子数：
  40.0
• 可旋转键数：
  13.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  74.3
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  (R)-4-benzyl-3-((2R,3S,5S)-5,7-bis((tert-butyldimethylsilyl)oxy)-3-methoxy-2-methylheptanoyl)oxazolidin-2-one 在 锂硼氢 、 戴斯-马丁氧化剂 作用下， 以 四氢呋喃 、 甲醇 、 二氯甲烷 为溶剂， 反应 3.5h， 生成 (2R,3S,5S)-5,7-bis((tert-butyldimethylsilyl)oxy)-3-methoxy-2-methylheptanal
  参考文献：
  名称：

  Design, Synthesis, and Biological Evaluations of Aplyronine A–Mycalolide B Hybrid Compound

  摘要：

  A hybrid compound consisting of aplyronine A and mycalolide B was synthesized, and its biological activities were evaluated. The hybrid compound was found to have somewhat more potent actin-depolymerizing activity than aplyronine A. In contrast, the hybrid compound possessed about 1000-fold less cytotoxicity than aplyronine A. These results indicated that there is no direct correlation between actin-depolymerizing activity and cytotoxicity.

  DOI：

  10.1021/ol300182r
• 作为产物：
  描述：

  (S)-3,5-bis((tert-butyldimethylsilyl)oxy)pentanal 在 2,6-二叔丁基吡啶 、 四氯化钛 、 (+)-鹰爪豆碱 作用下， 以 二氯甲烷 为溶剂， 反应 19.0h， 生成 (R)-4-benzyl-3-((2R,3S,5S)-5,7-bis((tert-butyldimethylsilyl)oxy)-3-methoxy-2-methylheptanoyl)oxazolidin-2-one
  参考文献：
  名称：

  Design, Synthesis, and Biological Evaluations of Aplyronine A–Mycalolide B Hybrid Compound

  摘要：

  A hybrid compound consisting of aplyronine A and mycalolide B was synthesized, and its biological activities were evaluated. The hybrid compound was found to have somewhat more potent actin-depolymerizing activity than aplyronine A. In contrast, the hybrid compound possessed about 1000-fold less cytotoxicity than aplyronine A. These results indicated that there is no direct correlation between actin-depolymerizing activity and cytotoxicity.

  DOI：

  10.1021/ol300182r