(3S,4R,5S)-5-[(R)-(3,4-dimethoxyphenyl)-hydroxymethyl]-4-(4-methoxyphenyl)oxolan-3-ol | 1264005-14-2

• 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: (3S,4R,5S)-5-[(R)-(3,4-dimethoxyphenyl)-hydroxymethyl]-4-(4-methoxyphenyl)oxolan-3-ol
• CAS: 1264005-14-2
• 化学式: C₂₀H₂₄O₆
• 分子量: 360.407
• InChiKey: VOBMPBLQBUANQN-XLNTUCKNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  77.4
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  (S)-MTPA 、 (3S,4R,5S)-5-[(R)-(3,4-dimethoxyphenyl)-hydroxymethyl]-4-(4-methoxyphenyl)oxolan-3-ol 在 4-二甲氨基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 24.0h， 以1.2 mg的产率得到
  参考文献：
  名称：

  Terpenoids and Norlignans from Metasequoia glyptostroboides

  摘要：

  Four new terpenoids, metaseglyptorin A (1), metasequoic acid C (2), 12 alpha-hydroxy-8,15-isopimaradien-18-oic acid (3), and (-)-acora-2,4(14),8-trien-15-oic acid (4), and three new norlignans, metasequirins D-F (5-7), were isolated from Metasequoia glyptostroboides, together with 15 known compounds. Structures of the new compounds were determined by analysis of their spectroscopic data, and the absolute configuration of 7 was established by the modified Mosher method. All of the compounds were evaluated for cytotoxicity against five human tumor cell lines.

  DOI：

  10.1021/np100694k
• 作为产物：
  描述：

  重氮甲烷 、 metasequirin F 以 四氢呋喃 、 乙醚 为溶剂， 以100%的产率得到(3S,4R,5S)-5-[(R)-(3,4-dimethoxyphenyl)-hydroxymethyl]-4-(4-methoxyphenyl)oxolan-3-ol
  参考文献：
  名称：

  Terpenoids and Norlignans from Metasequoia glyptostroboides

  摘要：

  Four new terpenoids, metaseglyptorin A (1), metasequoic acid C (2), 12 alpha-hydroxy-8,15-isopimaradien-18-oic acid (3), and (-)-acora-2,4(14),8-trien-15-oic acid (4), and three new norlignans, metasequirins D-F (5-7), were isolated from Metasequoia glyptostroboides, together with 15 known compounds. Structures of the new compounds were determined by analysis of their spectroscopic data, and the absolute configuration of 7 was established by the modified Mosher method. All of the compounds were evaluated for cytotoxicity against five human tumor cell lines.

  DOI：

  10.1021/np100694k