(2R,4aR,6S,7R,8R,8aS)-2-(4-Methoxy-phenyl)-6-phenyl-hexahydro-pyrano[3,2-d][1,3]dioxine-7,8-diol | 882301-86-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (2R,4aR,6S,7R,8R,8aS)-2-(4-Methoxy-phenyl)-6-phenyl-hexahydro-pyrano[3,2-d][1,3]dioxine-7,8-diol
• CAS: 882301-86-2
• 化学式: C₂₀H₂₂O₆
• 分子量: 358.391
• InChiKey: GQIICJNMGPWBPX-IGOIZDSHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.97
• 重原子数：
  26.0
• 可旋转键数：
  3.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  77.38
• 氢给体数：
  2.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  (2R,4aR,6S,7R,8R,8aS)-2-(4-Methoxy-phenyl)-6-phenyl-hexahydro-pyrano[3,2-d][1,3]dioxine-7,8-diol 、 碘甲烷 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 0.5h， 生成 (2R,4aR,6S,7S,8R,8aR)-7,8-Dimethoxy-2-(4-methoxy-phenyl)-6-phenyl-hexahydro-pyrano[3,2-d][1,3]dioxine
  参考文献：
  名称：

  Synthesis and screening of bicyclic carbohydrate-based compounds: A novel type of antivirals

  摘要：

  A small library of bicyclic carbohydrate derivatives was synthesized and screened. A strong and selective activity against cytomegalovirus was found. Structure-activity relationship for this new type of antivirals is discussed. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.12.048
• 作为产物：
  描述：

  (2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)benzene 在 camphor-10-sulfonic acid 、 potassium carbonate 、 copper(II) sulfate 作用下， 以 四氢呋喃 、 甲醇 、 乙腈 为溶剂， 反应 21.0h， 生成 (2R,4aR,6S,7R,8R,8aS)-2-(4-Methoxy-phenyl)-6-phenyl-hexahydro-pyrano[3,2-d][1,3]dioxine-7,8-diol
  参考文献：
  名称：

  Synthesis and screening of bicyclic carbohydrate-based compounds: A novel type of antivirals

  摘要：

  A small library of bicyclic carbohydrate derivatives was synthesized and screened. A strong and selective activity against cytomegalovirus was found. Structure-activity relationship for this new type of antivirals is discussed. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.12.048