(E)-1-(1,3-bis(2,2-dimethyl-1,3-dioxan-5-yloxy)propan-2-yl)-4-((3-(methoxymethoxy)-5-(4-(methoxymethoxy)styryl)phenoxy)methyl)-1H-1,2,3-triazole | 1392500-17-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: (E)-1-(1,3-bis(2,2-dimethyl-1,3-dioxan-5-yloxy)propan-2-yl)-4-((3-(methoxymethoxy)-5-(4-(methoxymethoxy)styryl)phenoxy)methyl)-1H-1,2,3-triazole
• 英文别名: 1-[1,3-bis[(2,2-dimethyl-1,3-dioxan-5-yl)oxy]propan-2-yl]-4-[[3-(methoxymethoxy)-5-[(E)-2-[4-(methoxymethoxy)phenyl]ethenyl]phenoxy]methyl]triazole
• CAS: 1392500-17-2
• 化学式: C₃₆H₄₉N₃O₁₁
• 分子量: 699.799
• InChiKey: OVXFFKINKFDKBB-BQYQJAHWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  50
• 可旋转键数：
  18
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  132
• 氢给体数：
  0
• 氢受体数：
  13

反应信息

• 作为反应物：
  描述：

  (E)-1-(1,3-bis(2,2-dimethyl-1,3-dioxan-5-yloxy)propan-2-yl)-4-((3-(methoxymethoxy)-5-(4-(methoxymethoxy)styryl)phenoxy)methyl)-1H-1,2,3-triazole 在 甲醇 作用下， 反应 120.0h， 以89%的产率得到(E)-2,2'-(2-(4-((3-hydroxy-5-(4-hydroxystyryl)phenoxy)methyl)-1H-1,2,3-triazol-1-yl)propane-1,3-diyl)bis(oxy)dipropane-1,3-diol
  参考文献：
  名称：

  Synthesis and evaluation of water-soluble resveratrol and piceatannol via BGLation

  摘要：

  Synthesis of four water-soluble resveratrol and piceatannol derivatives bearing symmetrically branched glyceryl trimer (BGL003) with a non-biocleavable linkage, and their biological evaluation as a mitochondrial fusion-inducing agent with cellular fat-reducing effect from cells, is described. The effect of Piceatannol-BGL003 conjugate was as high as that of original stilbenoids. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.06.019
• 作为产物：
  描述：

  1,3-双[(2,2-二甲基-1,3-二恶烷-5-基)氧代]-2-丙醇 在 吡啶 、 4-二甲氨基吡啶 、 copper(l) iodide 、 sodium azide 、 N,N-二异丙基乙胺 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 为溶剂， 反应 41.0h， 生成 (E)-1-(1,3-bis(2,2-dimethyl-1,3-dioxan-5-yloxy)propan-2-yl)-4-((3-(methoxymethoxy)-5-(4-(methoxymethoxy)styryl)phenoxy)methyl)-1H-1,2,3-triazole
  参考文献：
  名称：

  Synthesis and evaluation of water-soluble resveratrol and piceatannol via BGLation

  摘要：

  Synthesis of four water-soluble resveratrol and piceatannol derivatives bearing symmetrically branched glyceryl trimer (BGL003) with a non-biocleavable linkage, and their biological evaluation as a mitochondrial fusion-inducing agent with cellular fat-reducing effect from cells, is described. The effect of Piceatannol-BGL003 conjugate was as high as that of original stilbenoids. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.06.019

文献信息

• Synthesis and evaluation of water-soluble resveratrol and piceatannol via BGLation
  作者：Hisao Nemoto、Ayato Katagiri、Masaki Kamiya、Tsuyoshi Matsushita、Hatsuhiko Hattori、Kosuke Matsumura、Tomohiro Itou、Tomoyuki Kawamura、Toshiyuki Kita、Hana Nishida、Naokatu Arakaki

  DOI：10.1016/j.bmcl.2012.06.019

  日期：2012.8

  Synthesis of four water-soluble resveratrol and piceatannol derivatives bearing symmetrically branched glyceryl trimer (BGL003) with a non-biocleavable linkage, and their biological evaluation as a mitochondrial fusion-inducing agent with cellular fat-reducing effect from cells, is described. The effect of Piceatannol-BGL003 conjugate was as high as that of original stilbenoids. (C) 2012 Elsevier Ltd. All rights reserved.