Sulfuric acid mono-[1-(3-hydroxy-propyl)-3-methyl-butyl] ester | 134887-82-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机硫酸及其衍生物
• 英文名称: Sulfuric acid mono-[1-(3-hydroxy-propyl)-3-methyl-butyl] ester
• 英文别名: (1-Hydroxy-6-methylheptan-4-yl) hydrogen sulfate；(1-hydroxy-6-methylheptan-4-yl) hydrogen sulfate
• CAS: 134887-82-4
• 化学式: C₈H₁₈O₅S
• 分子量: 226.294
• InChiKey: JXNMVOQLLXBSOP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  14
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  92.2
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  6-Methyl-1-trityloxy-heptan-4-ol 在 palladium on activated charcoal 、 氢气 、 三氧化硫吡啶 作用下， 生成 Sulfuric acid mono-[1-(3-hydroxy-propyl)-3-methyl-butyl] ester
  参考文献：
  名称：

  Musclide-A1, -A2, and -B, cardiotonic potentiating principles from musk

  摘要：

  Three new aliphatic sulfates, musclide-A1 (a mixture of 1a and 2a), -A2 (4a), and -B (6a), were isolated from musk, one of the most famous traditional Chinese medicines and their structures were determined. These compounds have a cardiotonic potentiating activity.

  DOI：

  10.1016/s0040-4039(00)74316-4

文献信息

• JPH03294259A
  申请人：——

  公开号：JPH03294259A

  公开（公告）日：1991-12-25
• Musclide-A1, -A2, and -B, cardiotonic potentiating principles from musk
  作者：Shigetoshi Kadota、Tetsuya Orito、Tohru Kikuchi、Teruko Uwano、Ikuko Kimura、Masayasu Kimura

  DOI：10.1016/s0040-4039(00)74316-4

  日期：1991.4

  Three new aliphatic sulfates, musclide-A1 (a mixture of 1a and 2a), -A2 (4a), and -B (6a), were isolated from musk, one of the most famous traditional Chinese medicines and their structures were determined. These compounds have a cardiotonic potentiating activity.