(S)-(+)-12-methyltetradecanoic acid methyl ester | 62691-05-8

• 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: (S)-(+)-12-methyltetradecanoic acid methyl ester
• 英文别名: (S)-12-methyl-tetradecanoic acid methyl ester；(S)-12-methyltetradecanoic acid methyl ester；(S)-(methyl 12-methyltetradecanoate)；methyl (S)-12-methyltetradecanoate；(S)-12-methyl-tetradecanoic acid methyl ester；(S)-12-Methyl-tetradecansaeure-methylester；methyl (12S)-12-methyltetradecanoate
• CAS: 62691-05-8
• 化学式: C₁₆H₃₂O₂
• 分子量: 256.429
• InChiKey: BJIUDNXPLSJWKE-HNNXBMFYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  18
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  (S)-12-methyltetradecanoic acid 生成 (S)-(+)-12-methyltetradecanoic acid methyl ester
  参考文献：
  名称：

  Liu, Fu Ssu-Nien-Gedenkschrift S.199,203

  摘要：

  DOI：

文献信息

• Synthesis of Both the Enantiomers of Aseanostatin P5 (Sarcinic Acid), an Inhibitor of Myeloperoxidase Release, and Four Diastereomers of Aggreceride A, a Platelet Aggregation Inhibitor
  作者：Takeshi Kitahara、Shigeru Aono、Kenji Mori

  DOI：10.1271/bbb.59.78

  日期：1995.1

  Both the enantiomers of aseanostatin P5 (sarcinic acid), an inhibitor of myeloperoxidase (MPO) release from human polymorphonuclear leukocytes (PMN), with high optical purity were synthesized by starting from (S)-2-methylbutanol and methyl (S)-3-hydroxy-2-methylpropanoate. They were converted to four diastereomers of aggreceride A, a platelet aggregation inhibitor.

  从（S）-2-甲基丁醇和甲基（S）-3起始合成两种具有高光学纯度的人骨过氧化物酶P5（肌氨酸）的对映异构体-羟基-2-甲基丙酸酯。它们被转化为血小板聚集抑制剂agreceride A的四个非对映异构体。
• Structure of a secoisolariciresinol diester from Salvia plebeia seed
  作者：Richard G. Powell、Ronald D. Platiner

  DOI：10.1016/s0031-9422(00)88856-1

  日期：1976.1