| 1244028-37-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• CAS: 1244028-37-2
• 化学式: C₁₅H₁₉N₃O₅S
• 分子量: 353.399
• InChiKey: SGGYSHCLYVHFIM-STQMWFEESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.81
• 重原子数：
  24.0
• 可旋转键数：
  9.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  113.93
• 氢给体数：
  2.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  在 2-[butyl-[2-(dimethylamino)phenyl]phosphanyl]-N,N-dimethylaniline 作用下， 以 四氢呋喃 为溶剂， 反应 0.02h， 生成 methyl 2-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]prop-2-enoate
  参考文献：
  名称：

  Facile Formation of Dehydroalanine From S-Nitrosocysteines

  摘要：

  A reductive elimination of S-nitrosocysteines using phosphine substrates has been developed. This reaction converts unstable S-nitrosocysteines to dehydroalanine derivatives under very mild conditions. It can potentially be applied for the detection of protein S-nitrosation.

  DOI：

  10.1021/ja905558w
• 作为产物：
  描述：

  methyl acetyl-L-phenylalanyl-L-cysteinate 在 盐酸 、 sodium nitrite 作用下， 以 甲醇 、 水 为溶剂， 反应 0.5h， 生成
  参考文献：
  名称：

  Facile Formation of Dehydroalanine From S-Nitrosocysteines

  摘要：

  A reductive elimination of S-nitrosocysteines using phosphine substrates has been developed. This reaction converts unstable S-nitrosocysteines to dehydroalanine derivatives under very mild conditions. It can potentially be applied for the detection of protein S-nitrosation.

  DOI：

  10.1021/ja905558w

文献信息

• Disulfide formation via sulfenamides
  作者：Jia Pan、Ming Xian

  DOI：10.1039/c0cc02076a

  日期：——

  A phosphine-mediated one-step disulfide formation from S-nitrosothiols has been developed. This reaction can convert unstable S-nitrosothiols to stable disulfidesviasulfenamide intermediates under very mild conditions. It has the potential to be used for the detection ofS-nitrosothiols.

  我们开发了一种由磷化氢介导的一步法 S-亚硝硫醇二硫化物形成反应。该反应可在非常温和的条件下将不稳定的 S-亚硝硫醇转化为稳定的二硫化物-亚硫酰胺中间体。它具有用于检测 S-亚硝硫醇的潜力。
• One-Pot Thioether Formation from<i>S</i>-Nitrosothiols
  作者：Dehui Zhang、Nelmi O. Devarie-Baez、Jia Pan、Hua Wang、Ming Xian

  DOI：10.1021/ol102491n

  日期：2010.12.17

  Protein S-nitrosation is an important post-translational modification. However, the detection of S-nitrosation is still problematic because S-nitrosation products, that is, S-nitrosothiols, are unstable species. Here a new reaction which can selectively convert unstable S-nitrosothiols to stable thioethers in one-pot under very mild conditions is reported. This reaction has the potential to be applied in the detection of protein S-nitrosation.