ethyl 4-oxo-4-[[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]amino]butanoate | 1000591-96-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 鞘脂
• 英文名称: ethyl 4-oxo-4-[[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]amino]butanoate
• CAS: 1000591-96-7
• 化学式: C₂₄H₄₇NO₆
• 分子量: 445.64
• InChiKey: DIAXVPIIYCNBAR-IMSXRSKXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  31
• 可旋转键数：
  22
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  116
• 氢给体数：
  4
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  糖脂 、 丁二酸单乙酯酰氯 在 N,N-二异丙基乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 1.0h， 生成 ethyl 4-oxo-4-[[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]amino]butanoate
  参考文献：
  名称：

  Synthesis of novel phytosphingosine derivatives and their preliminary biological evaluation for enhancing radiation therapy

  摘要：

  Eight D-ribo-phytosphingosine derivatives were synthesized from D-ribo-phytosphingosine and diverse acyl chlorides with N,N-diisopropylethylamine in tetrahydrofuran for 1 h at room temperature. Effect of these compounds on IR-induced cell death was evaluated on blood cancer cells (Jurkat). Among these, 3d showed the highest enhancement of radiosensitizing effect. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.09.037

文献信息

• Synthesis of novel phytosphingosine derivatives and their preliminary biological evaluation for enhancing radiation therapy
  作者：Byung Seok Moon、Moon-Taek Park、Jeong Hoon Park、Sang Wook Kim、Kyo Chul Lee、Gwang Il An、Seung Dae Yang、Dae Yoon Chi、Gi Jeong Cheon、Su-Jae Lee

  DOI：10.1016/j.bmcl.2007.09.037

  日期：2007.12

  Eight D-ribo-phytosphingosine derivatives were synthesized from D-ribo-phytosphingosine and diverse acyl chlorides with N,N-diisopropylethylamine in tetrahydrofuran for 1 h at room temperature. Effect of these compounds on IR-induced cell death was evaluated on blood cancer cells (Jurkat). Among these, 3d showed the highest enhancement of radiosensitizing effect. (c) 2007 Elsevier Ltd. All rights reserved.