2-((2R,4aR,5R)-4a,8-Dimethyl-7-oxo-5-phenylsulfanyl-1,2,3,4,4a,5,6,7-octahydro-naphthalen-2-yl)-propionic acid methyl ester | 135441-95-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 2-((2R,4aR,5R)-4a,8-Dimethyl-7-oxo-5-phenylsulfanyl-1,2,3,4,4a,5,6,7-octahydro-naphthalen-2-yl)-propionic acid methyl ester
• 英文别名: methyl 2-[(2R,4aR,5R)-4a,8-dimethyl-7-oxo-5-phenylsulfanyl-1,2,3,4,5,6-hexahydronaphthalen-2-yl]propanoate
• CAS: 135441-95-1
• 化学式: C₂₂H₂₈O₃S
• 分子量: 372.529
• InChiKey: IZQPJUSBCMIOGU-SKIBPDHRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  26
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  68.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  山道年 在 sodium 作用下， 以 乙醚 为溶剂， 反应 20.0h， 生成 2-((2R,4aR,5R)-4a,8-Dimethyl-7-oxo-5-phenylsulfanyl-1,2,3,4,4a,5,6,7-octahydro-naphthalen-2-yl)-propionic acid methyl ester
  参考文献：
  名称：

  Organosulfur and organoselenium mediated reductive cleavage of certain γ-enonelactones

  摘要：

  Reduction of the alkyl-oxygen bond of several gamma-enonelactones is readily accomplished in high yield with PhSeNa or PhSNa reagents. The reaction has been extended to several sesquiterpenoid lactones of the santonin and isophotosantonin groups.

  DOI：

  10.1016/s0040-4039(00)92723-0

文献信息

• Organosulfur and organoselenium mediated reductive cleavage of certain γ-enonelactones
  作者：Cosme G. Francisco、Raimundo Freire、Maria S. Rodríguez、Ernesto Suárez

  DOI：10.1016/s0040-4039(00)92723-0

  日期：1991.7

  Reduction of the alkyl-oxygen bond of several gamma-enonelactones is readily accomplished in high yield with PhSeNa or PhSNa reagents. The reaction has been extended to several sesquiterpenoid lactones of the santonin and isophotosantonin groups.