3-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3H,12H-1,3,12-triaza-chrysene-2,11-dione | 610303-50-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 3-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3H,12H-1,3,12-triaza-chrysene-2,11-dione
• 英文别名: 4-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6,8-triazatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,6,11,13,15,17-heptaene-5,9-dione
• CAS: 610303-50-9
• 化学式: C₂₀H₁₇N₃O₅
• 分子量: 379.372
• InChiKey: FZCJAWYZVVGFFF-ARFHVFGLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  28
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  112
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  3-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3H,12H-1,3,12-triaza-chrysene-2,11-dione 在 吡啶 、 四氮唑 作用下， 以 乙腈 为溶剂， 反应 8.0h， 生成 Diisopropyl-phosphoramidous acid (2R,3S,5R)-2-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-5-(2,11-dioxo-11,12-dihydro-2H-1,3,12-triaza-chrysen-3-yl)-tetrahydro-furan-3-yl ester 2-cyano-ethyl ester
  参考文献：
  名称：

  Synthesis and properties of a novel fluorescent nucleobase, naphthopyridopyrimidine

  摘要：

  A new base-discriminating fluorescent nucleoside, NPP, that can sharply distinguish between A and G bases opposite NPP is described. The hybridization of an ODN probe containing NPP with a target DNA facilitates the judgment of the type of purine base located at a specific site on the target DNA. (C) 2003 Published by Elsevier Ltd.

  DOI：

  10.1016/s0040-4039(03)01740-4
• 作为产物：
  描述：

  5-碘-2'-脱氧胞苷 在 吡啶 、 咪唑 、 甲醇 、 ammonium hydroxide 、 氯仿 、 四丁基氟化铵 、 methyloxirane 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 、 苯 为溶剂， 反应 39.12h， 生成 3-((2R,4S,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3H,12H-1,3,12-triaza-chrysene-2,11-dione
  参考文献：
  名称：

  Synthesis and properties of a novel fluorescent nucleobase, naphthopyridopyrimidine

  摘要：

  A new base-discriminating fluorescent nucleoside, NPP, that can sharply distinguish between A and G bases opposite NPP is described. The hybridization of an ODN probe containing NPP with a target DNA facilitates the judgment of the type of purine base located at a specific site on the target DNA. (C) 2003 Published by Elsevier Ltd.

  DOI：

  10.1016/s0040-4039(03)01740-4

文献信息

• Synthesis and properties of a novel fluorescent nucleobase, naphthopyridopyrimidine
  作者：Akimitsu Okamoto、Kazuki Tainaka、Isao Saito

  DOI：10.1016/s0040-4039(03)01740-4

  日期：2003.9

  A new base-discriminating fluorescent nucleoside, NPP, that can sharply distinguish between A and G bases opposite NPP is described. The hybridization of an ODN probe containing NPP with a target DNA facilitates the judgment of the type of purine base located at a specific site on the target DNA. (C) 2003 Published by Elsevier Ltd.