1-O-(11-phenylundecyl)-2-hexadecanoylamino-2-deoxy-sn-glycerol | 154093-86-4

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 1-O-(11-phenylundecyl)-2-hexadecanoylamino-2-deoxy-sn-glycerol
• 英文别名: N-[(2S)-1-hydroxy-3-(11-phenylundecoxy)propan-2-yl]hexadecanamide
• CAS: 154093-86-4
• 化学式: C₃₆H₆₅NO₃
• 分子量: 559.917
• InChiKey: ZKJBAMUAMAWEIR-DHUJRADRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.6
• 重原子数：
  40
• 可旋转键数：
  30
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  58.6
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-O-(11-phenylundecyl)-2-hexadecanoylamino-2-deoxy-sn-glycerol 在 potassium chloride 、 三乙胺 作用下， 以 氯仿 为溶剂， 反应 53.0h， 生成 [(2R)-2-(hexadecanoylamino)-3-(11-phenylundecoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
  参考文献：
  名称：

  A Convenient Synthesis of 1-Ether-2-acylamido-2-deoxy-sn-glycerophospholipids

  摘要：

  A series of 1-ether-sn-2-acylamidoglycerophospholipids, bearing different polar heads in sn-3-position such as phosphoglycol, -serine, -ethanolamine or -choline, have been prepared. Except for the choline derivative which was synthesized from a beta-carbamate alcohol derivative, the remaining compounds were obtained from beta-amidoalcohols.

  DOI：

  10.1080/00397919308011175
• 作为产物：
  描述：

  11-phenylundecyl methanesulfonate 在 盐酸 、 4-二甲氨基吡啶 、 potassium hydride 作用下， 以 乙醇 、 氯仿 为溶剂， 反应 44.0h， 生成 1-O-(11-phenylundecyl)-2-hexadecanoylamino-2-deoxy-sn-glycerol
  参考文献：
  名称：

  A Convenient Synthesis of 1-Ether-2-acylamido-2-deoxy-sn-glycerophospholipids

  摘要：

  A series of 1-ether-sn-2-acylamidoglycerophospholipids, bearing different polar heads in sn-3-position such as phosphoglycol, -serine, -ethanolamine or -choline, have been prepared. Except for the choline derivative which was synthesized from a beta-carbamate alcohol derivative, the remaining compounds were obtained from beta-amidoalcohols.

  DOI：

  10.1080/00397919308011175

文献信息

• A Convenient Synthesis of 1-Ether-2-acylamido-2-deoxy-<i>sn</i>-glycerophospholipids
  作者：M. L. García、J. Pascual、G. González、A. Palomer、M. Cabré、J. A. Andreu、D. Mauleón、G. Carganico

  DOI：10.1080/00397919308011175

  日期：1993.12

  A series of 1-ether-sn-2-acylamidoglycerophospholipids, bearing different polar heads in sn-3-position such as phosphoglycol, -serine, -ethanolamine or -choline, have been prepared. Except for the choline derivative which was synthesized from a beta-carbamate alcohol derivative, the remaining compounds were obtained from beta-amidoalcohols.