S-(2-hydroxyethyl) phenylmethanethiosulfinate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: S-(2-hydroxyethyl) phenylmethanethiosulfinate
• 英文别名: 2-Benzylsulfinylsulfanylethanol
• 化学式: C₉H₁₂O₂S₂
• 分子量: 216.325
• InChiKey: XYTFNAGXLVIKGJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  13
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  81.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  Benzyl-2-hydroxyethyl-disulfid 在 间氯过氧苯甲酸 作用下， 以 氯仿 为溶剂， 反应 0.5h， 生成 S-(2-hydroxyethyl) phenylmethanethiosulfinate 、 S-benzyl 2-hydroxyethanethiosulfinate
  参考文献：
  名称：

  S-Substituted cysteine derivatives and thiosulfinate formation in Petiveria alliacea—part II

  摘要：

  Three cysteine derivatives, (R)-S-(2-hydroxyethyl)cysteine, together with (RSRC)- and (SSRC)-S-(2-hydroxyethyl)cysteine sulfoxides, have been isolated from the roots of Petiveria alliacea. Furthermore, three additional amino acids, S-methyl-, S-ethyl-, and S-propyleysteine derivatives, were detected. They were present only in trace amounts ( < 3 mug g(-1) fr. wt), precluding determination of their absolute configurations and oxidation states. In addition, four thiosulfinates, S-(2-hydroxyethyl) (2-hydroxyethane)-, S-(2-hydroxyethyl) phenylmethane-, S-benzyl (2-hydroxyethane)- and S-benzyl phenylmethanethiosulfinates, have been found in a homogenate of the roots. The formation pathways of various benzyl/phenyl-containing compounds previously found in the plant were also discussed. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0031-9422(02)00328-x

文献信息

• S-Substituted cysteine derivatives and thiosulfinate formation in Petiveria alliacea—part II
  作者：Roman Kubec、Seokwon Kim、Rabi A. Musah

  DOI：10.1016/s0031-9422(02)00328-x

  日期：2002.11

  Three cysteine derivatives, (R)-S-(2-hydroxyethyl)cysteine, together with (RSRC)- and (SSRC)-S-(2-hydroxyethyl)cysteine sulfoxides, have been isolated from the roots of Petiveria alliacea. Furthermore, three additional amino acids, S-methyl-, S-ethyl-, and S-propyleysteine derivatives, were detected. They were present only in trace amounts ( < 3 mug g(-1) fr. wt), precluding determination of their absolute configurations and oxidation states. In addition, four thiosulfinates, S-(2-hydroxyethyl) (2-hydroxyethane)-, S-(2-hydroxyethyl) phenylmethane-, S-benzyl (2-hydroxyethane)- and S-benzyl phenylmethanethiosulfinates, have been found in a homogenate of the roots. The formation pathways of various benzyl/phenyl-containing compounds previously found in the plant were also discussed. (C) 2002 Elsevier Science Ltd. All rights reserved.