[(2R)-2-(hexadecanoylamino)-3-(16-phenylhexadecoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: [(2R)-2-(hexadecanoylamino)-3-(16-phenylhexadecoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
• 化学式: C₄₆H₈₇N₂O₆P
• 分子量: 795.18
• InChiKey: BBBPKJWNZPTASI-WBVITSLISA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.7
• 重原子数：
  55
• 可旋转键数：
  41
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.85
• 拓扑面积：
  96.9
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  (2S)-2-amino-3-(16-phenylhexadecoxy)propan-1-ol 在 4-二甲氨基吡啶 、 potassium chloride 、 三乙胺 作用下， 以 氯仿 为溶剂， 反应 54.5h， 生成 [(2R)-2-(hexadecanoylamino)-3-(16-phenylhexadecoxy)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

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.