7-Hydroxy-2-oxo-2H-chromene-3-carboxylic acid [(2R,3R,4S,5R)-5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-yl]-amide | 282543-36-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: 7-Hydroxy-2-oxo-2H-chromene-3-carboxylic acid [(2R,3R,4S,5R)-5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-yl]-amide
• CAS: 282543-36-6
• 化学式: C₄₀H₃₅N₃O₁₁
• 分子量: 733.731
• InChiKey: XSXIIDMZENZYFP-GBIKHXGCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.43
• 重原子数：
  54.0
• 可旋转键数：
  11.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  191.55
• 氢给体数：
  4.0
• 氢受体数：
  12.0

反应信息

• 作为反应物：
  描述：

  7-Hydroxy-2-oxo-2H-chromene-3-carboxylic acid [(2R,3R,4S,5R)-5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-yl]-amide 在 四氮唑 作用下， 以 吡啶 、 二氯甲烷 为溶剂， 生成 [3-[[(2R,3R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-2-(2,4-dioxopyrimidin-1-yl)oxolan-3-yl]carbamoyl]-2-oxochromen-7-yl] 2,2-dimethylpropanoate
  参考文献：
  名称：

  Coumarin–fluorescein pair as a new donor–acceptor set for fluorescence energy transfer study of DNA

  摘要：

  A method for introduction of the 2'-coumarin labeled nucleoside as a fluorescence energy donor into DNA duplexes has been described. Efficient FRET occurs between the coumarin-fluorescein pair in DNA owing to the high quantum yield of the donor. The present donor-acceptor pair may be useful as FRET indicator of DNA structures in solution, (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)00215-x
• 作为产物：
  描述：

  7-羟基香豆素-3-羧酸 在 1-羟基苯并三唑 、 N,N'-二环己基碳二亚胺 作用下， 以 吡啶 、 N,N-二甲基甲酰胺 为溶剂， 生成 7-Hydroxy-2-oxo-2H-chromene-3-carboxylic acid [(2R,3R,4S,5R)-5-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-2-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-4-hydroxy-tetrahydro-furan-3-yl]-amide
  参考文献：
  名称：

  Coumarin–fluorescein pair as a new donor–acceptor set for fluorescence energy transfer study of DNA

  摘要：

  A method for introduction of the 2'-coumarin labeled nucleoside as a fluorescence energy donor into DNA duplexes has been described. Efficient FRET occurs between the coumarin-fluorescein pair in DNA owing to the high quantum yield of the donor. The present donor-acceptor pair may be useful as FRET indicator of DNA structures in solution, (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)00215-x