(1R,2R,3S,4R,5R)-4-Benzyloxy-3-methoxy-2-(4-methoxy-phenoxy)-6,8-dioxa-bicyclo[3.2.1]octane | 226069-54-1

• 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: (1R,2R,3S,4R,5R)-4-Benzyloxy-3-methoxy-2-(4-methoxy-phenoxy)-6,8-dioxa-bicyclo[3.2.1]octane
• CAS: 226069-54-1
• 化学式: C₂₁H₂₄O₆
• 分子量: 372.418
• InChiKey: KUELWAMCTOIRDI-YMQHIKHWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  27.0
• 可旋转键数：
  7.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  55.38
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  (1R,2R,3S,4R,5R)-4-Benzyloxy-3-methoxy-2-(4-methoxy-phenoxy)-6,8-dioxa-bicyclo[3.2.1]octane 在 caesium carbonate 、 苄胺 、 三氟乙酸 作用下， 以 乙醚 、 二氯甲烷 为溶剂， 反应 24.0h， 生成
  参考文献：
  名称：

  Synthetic oligosaccharides having various functional domains: Potent and potentially safe heparin mimetics

  摘要：

  A synthetic heptadecasaccharide, comprising an antithrombin III binding domain, a thrombin binding domain, and a neutral methylated hexasaccharide sequence, was obtained through a convergent synthesis. This compound displayed in vitro anticoagulant properties similar to that of standard heparin but, in contrast with heparin, escaped neutralization by platelet factor 4, a protein released by activated platelets. (C) 1999 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00156-0
• 作为产物：
  描述：

  Toluene-4-sulfonic acid (1R,2S,3S,4R,5R)-3-hydroxy-2-(4-methoxy-phenoxy)-6,8-dioxa-bicyclo[3.2.1]oct-4-yl ester 在 sodium hydride 、 苯甲醇钠 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 2.0h， 生成 (1R,2R,3S,4R,5R)-4-Benzyloxy-3-methoxy-2-(4-methoxy-phenoxy)-6,8-dioxa-bicyclo[3.2.1]octane
  参考文献：
  名称：

  Synthetic oligosaccharides having various functional domains: Potent and potentially safe heparin mimetics

  摘要：

  A synthetic heptadecasaccharide, comprising an antithrombin III binding domain, a thrombin binding domain, and a neutral methylated hexasaccharide sequence, was obtained through a convergent synthesis. This compound displayed in vitro anticoagulant properties similar to that of standard heparin but, in contrast with heparin, escaped neutralization by platelet factor 4, a protein released by activated platelets. (C) 1999 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00156-0