(1R,3E,13S,17S,19S)-6,7,9-trimethoxy-13-methyl-19-phenyl-12,18,20-trioxatricyclo[15.3.1.05,10]henicosa-3,5(10),6,8-tetraene-11,21-dione | 1206481-54-0

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酯类和类似物
• 英文名称: (1R,3E,13S,17S,19S)-6,7,9-trimethoxy-13-methyl-19-phenyl-12,18,20-trioxatricyclo[15.3.1.05,10]henicosa-3,5(10),6,8-tetraene-11,21-dione
• CAS: 1206481-54-0
• 化学式: C₂₈H₃₂O₈
• 分子量: 496.557
• InChiKey: OCRALPIGIBFVCU-ZKKQHWJESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  36
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  89.5
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  (1R,3E,13S,17S,19S)-6,7,9-trimethoxy-13-methyl-19-phenyl-12,18,20-trioxatricyclo[15.3.1.05,10]henicosa-3,5(10),6,8-tetraene-11,21-dione 在 盐酸 、 水 作用下， 以 甲醇 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of the proposed structure of queenslandon

  摘要：

  The proposed structure of the benzolactone queenslandon (6) was synthesized utilizing a triol containing building block prepared from D-ribose. While a ring-closing metathesis approach did not lead to the macrocycle, alkylation of a benzyl(phenyl)selane, elimination to generate the styrene double bond, followed by Mitsunobu macrolactonization proved to be successful. Spectral data suggest that the structure of queenslandon should be revised, probably to the C11 epimer. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.11.024
• 作为产物：
  描述：

  在 戴斯-马丁氧化剂 作用下， 以 二氯甲烷 为溶剂， 以94%的产率得到(1R,3E,13S,17S,19S)-6,7,9-trimethoxy-13-methyl-19-phenyl-12,18,20-trioxatricyclo[15.3.1.05,10]henicosa-3,5(10),6,8-tetraene-11,21-dione
  参考文献：
  名称：

  Synthesis of the proposed structure of queenslandon

  摘要：

  The proposed structure of the benzolactone queenslandon (6) was synthesized utilizing a triol containing building block prepared from D-ribose. While a ring-closing metathesis approach did not lead to the macrocycle, alkylation of a benzyl(phenyl)selane, elimination to generate the styrene double bond, followed by Mitsunobu macrolactonization proved to be successful. Spectral data suggest that the structure of queenslandon should be revised, probably to the C11 epimer. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.11.024