neocomplanine B | 1207177-56-7

• 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: neocomplanine B
• 英文别名: [4-(2-Hydroxynonylamino)-4-oxobutyl]-trimethylazanium
• CAS: 1207177-56-7
• 化学式: C₁₆H₃₅N₂O₂
• 分子量: 287.466
• InChiKey: GFPPOUGMKDGAFA-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  20
• 可旋转键数：
  12
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  γ-N,N,N-trimethylammonium butyroxy succinimide iodide 、 1-(n-heptyl)-2-aminoethanol 以 甲醇 为溶剂， 以47%的产率得到neocomplanine B
  参考文献：
  名称：

  Neocomplanines A and B, a Complanine Family Isolated from the Marine Fireworm

  摘要：

  Two new members of the complanine family, neocomplanines A (2) and B (3), were isolated as minor components of the methanolic extract of the "marine fireworm" Eurythoe complanata. The structures of the neocomplanines were revealed spectroscopically to be a trimethylammonium unit with a saturated carbon chain. The planar structures of neocomplanines A and B were confirmed successfully through total syntheses that used epichlorohydrin as a starting material. The neocomplanines show inflammatory activity and also enhanced PKC activity in combination with TPA in the presence of Ca(2+) in vitro; both arc similar to the effects of complanine (1). The molecular mechanism of the effects of complanine-related compounds is discussed.

  DOI：

  10.1021/np900694j

文献信息

• Neocomplanines A and B, a Complanine Family Isolated from the Marine Fireworm
  作者：Kazuhiko Nakamura、Yu Tachikawa、Osamu Ohno、Makoto Kitamura、Masami Suganuma、Daisuke Uemura

  DOI：10.1021/np900694j

  日期：2010.3.26

  Two new members of the complanine family, neocomplanines A (2) and B (3), were isolated as minor components of the methanolic extract of the "marine fireworm" Eurythoe complanata. The structures of the neocomplanines were revealed spectroscopically to be a trimethylammonium unit with a saturated carbon chain. The planar structures of neocomplanines A and B were confirmed successfully through total syntheses that used epichlorohydrin as a starting material. The neocomplanines show inflammatory activity and also enhanced PKC activity in combination with TPA in the presence of Ca(2+) in vitro; both arc similar to the effects of complanine (1). The molecular mechanism of the effects of complanine-related compounds is discussed.