2-Methylidene-3-[8-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-8-oxooctyl]butanedioic acid | 1046480-13-0

• 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: 2-Methylidene-3-[8-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-8-oxooctyl]butanedioic acid
• CAS: 1046480-13-0
• 化学式: C₁₈H₃₀N₂O₇
• 分子量: 386.445
• InChiKey: MLEDALKHVIAZSF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  27
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  142
• 氢给体数：
  4
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  2-Methylidene-3-[8-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-8-oxooctyl]butanedioic acid 在 三氟乙酸 作用下， 反应 1.0h， 生成 2-(8-Hydrazinyl-8-oxooctyl)-3-methylidenebutanedioic acid
  参考文献：
  名称：

  Synthesis and biological properties of tensyuic acids B, C, and E, and investigation of the optical purity of natural tensyuic acid B

  摘要：

  The first, concise total synthesis of (+/-)-tensyuic acids B, C, and E, using chemoselective formal S(N)2' type Grignard reactions and selective esterification, is described. In addition, the optical purity of natural (+/-)tensyuic acid B was determined using Chirabite-AR. Synthetic tensyuic acids, together with their intermediate compounds, were found to possess useful bioactive properties, with some of them showing potent activity against Trypanosorna brucei brucei strain GUTat 3.1. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.05.035
• 作为产物：
  描述：

  Dimethyl 2-methylidene-3-[8-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-8-oxooctyl]butanedioate 在 lithium hydroxide 作用下， 以 四氢呋喃 为溶剂， 生成 2-Methylidene-3-[8-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-8-oxooctyl]butanedioic acid
  参考文献：
  名称：

  Synthesis and biological properties of tensyuic acids B, C, and E, and investigation of the optical purity of natural tensyuic acid B

  摘要：

  The first, concise total synthesis of (+/-)-tensyuic acids B, C, and E, using chemoselective formal S(N)2' type Grignard reactions and selective esterification, is described. In addition, the optical purity of natural (+/-)tensyuic acid B was determined using Chirabite-AR. Synthetic tensyuic acids, together with their intermediate compounds, were found to possess useful bioactive properties, with some of them showing potent activity against Trypanosorna brucei brucei strain GUTat 3.1. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.05.035