(3S,4R,5R)-3-Dodecyl-4-hydroxy-5-methyl-dihydro-furan-2-one | 385842-94-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 内酯类
• 英文名称: (3S,4R,5R)-3-Dodecyl-4-hydroxy-5-methyl-dihydro-furan-2-one
• 英文别名: (3S,4R,5R)-3-dodecyl-4-hydroxy-5-methyloxolan-2-one
• CAS: 385842-94-4
• 化学式: C₁₇H₃₂O₃
• 分子量: 284.439
• InChiKey: BLVQHKZVRCPILI-PMPSAXMXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  20
• 可旋转键数：
  11
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (3S,4R,5R)-3-Dodecyl-4-hydroxy-5-methyl-dihydro-furan-2-one 在 吡啶 、 aluminum oxide 作用下， 以 氯仿 为溶剂， 生成 2-dodecyl-4α-methyl-2-butenolide
  参考文献：
  名称：

  Chemical Constituents from Alseodaphne andersonii

  摘要：

  Five new compounds, including four C-17 gamma-lactones, dihydroisoobtusilactone (A), dihydroobtusilactorie (2), 3-epilitsenolide D-2 (3), and 3-epilitsenolide D-1 (4), and one furanone alseodafuranone (V were isolated from the root and stem of Alseodaphne andersonii. Their structures were elucidated mainly by spectral analysis (NMR and MS) and partially by chemical correlation.

  DOI：

  10.1021/np010349f
• 作为产物：
  描述：

  3-epi-litsenolide D₂ 在 10percent Pd/C 氢气 作用下， 以 乙醇 为溶剂， 20.0 ℃ 、101.33 kPa 条件下， 以16.2 mg的产率得到(3S,4R,5R)-3-Dodecyl-4-hydroxy-5-methyl-dihydro-furan-2-one
  参考文献：
  名称：

  Chemical Constituents from Alseodaphne andersonii

  摘要：

  Five new compounds, including four C-17 gamma-lactones, dihydroisoobtusilactone (A), dihydroobtusilactorie (2), 3-epilitsenolide D-2 (3), and 3-epilitsenolide D-1 (4), and one furanone alseodafuranone (V were isolated from the root and stem of Alseodaphne andersonii. Their structures were elucidated mainly by spectral analysis (NMR and MS) and partially by chemical correlation.

  DOI：

  10.1021/np010349f

文献信息

• Chemical Constituents from <i>Alseodaphne andersonii</i>
  作者：Shoei-Sheng Lee、Show-Mei Chang、Chung-Hsiung Chen

  DOI：10.1021/np010349f

  日期：2001.12.1

  Five new compounds, including four C-17 gamma-lactones, dihydroisoobtusilactone (A), dihydroobtusilactorie (2), 3-epilitsenolide D-2 (3), and 3-epilitsenolide D-1 (4), and one furanone alseodafuranone (V were isolated from the root and stem of Alseodaphne andersonii. Their structures were elucidated mainly by spectral analysis (NMR and MS) and partially by chemical correlation.