7-[2-(4-methoxybenzyloxy)ethyl]-8,9,11,14-tetrahydro-7H-6,10-dioxabenzocyclododecen-5-one | 794588-67-3

• 分子结构分类: 有机化合物 - 苯类化合物
• 英文名称: 7-[2-(4-methoxybenzyloxy)ethyl]-8,9,11,14-tetrahydro-7H-6,10-dioxabenzocyclododecen-5-one
• CAS: 794588-67-3
• 化学式: C₂₄H₂₈O₅
• 分子量: 396.483
• InChiKey: QYMRIFKRPCTGPQ-TWKPZUECSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.35
• 重原子数：
  29.0
• 可旋转键数：
  6.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  53.99
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  7-[2-(4-methoxybenzyloxy)ethyl]-8,9,11,14-tetrahydro-7H-6,10-dioxabenzocyclododecen-5-one 在 RuCl2(1,3-dimesityl-imidazolidin-2-yl)(PCy3)(=CHPh) 作用下， 以 二氯甲烷 为溶剂， 反应 5.0h， 生成 7-[2-(4-methoxybenzyloxy)ethyl]-8,9,11,14-tetrahydro-7H-6,10-dioxabenzocyclododecen-5-one
  参考文献：
  名称：

  Ring-closing metathesis: a powerful tool for the synthesis of simplified salicylihalamide-based V-ATPase inhibitors

  摘要：

  Based on our synthetic strategy developed for the total synthesis of the macrocyclic salicylate natural product salicylihalamide, we describe herein the synthesis of a series of simplified salicylihalamide-based analogs. Alterations in the aromatic fragment, the macrolactone scaffold and side-chain were evaluated for in vitro inhibition of V-ATPase activity and human tumor cell growth. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2004.06.146
• 作为产物：
  描述：

  7-[2-(4-methoxybenzyloxy)ethyl]-8,9,11,14-tetrahydro-7H-6,10-dioxabenzocyclododecen-5-one 在 RuCl2(1,3-dimesityl-imidazolidin-2-yl)(PCy3)(=CHPh) 作用下， 以 二氯甲烷 为溶剂， 反应 5.0h， 生成 7-[2-(4-methoxybenzyloxy)ethyl]-8,9,11,14-tetrahydro-7H-6,10-dioxabenzocyclododecen-5-one
  参考文献：
  名称：

  Ring-closing metathesis: a powerful tool for the synthesis of simplified salicylihalamide-based V-ATPase inhibitors

  摘要：

  Based on our synthetic strategy developed for the total synthesis of the macrocyclic salicylate natural product salicylihalamide, we describe herein the synthesis of a series of simplified salicylihalamide-based analogs. Alterations in the aromatic fragment, the macrolactone scaffold and side-chain were evaluated for in vitro inhibition of V-ATPase activity and human tumor cell growth. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2004.06.146