1-(3'-氨基-3'-羧基丙基)尿嘧啶 | 69557-82-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 中文名称: 1-(3'-氨基-3'-羧基丙基)尿嘧啶
• 英文名称: L-1-amino-3-(1-uracilyl)butyric acid
• 英文别名: 1-(3'-Amino-3'-carboxypropyl)uracil；(2S)-2-amino-4-(2,4-dioxopyrimidin-1-yl)butanoic acid
• CAS: 69557-82-0
• 化学式: C₈H₁₁N₃O₄
• 分子量: 213.193
• InChiKey: JRUDOTYRCSMXFT-YFKPBYRVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -4
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  113
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  1-(3'-氨基-3'-羧基丙基)尿嘧啶 在 N-羟基-5-降冰片烯-2,3-二甲酰亚胺 、 茴香硫醚 、 碳酸氢钠 、 1-(3-二甲基氨基丙基)-3-乙基碳二亚胺 、 三乙胺 作用下， 以 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 反应 21.0h， 生成 (S)-2-[(S)-2-Amino-4-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-butyrylamino]-3-hydroxy-propionic acid methyl ester; compound with trifluoro-acetic acid
  参考文献：
  名称：

  Synthesis of Oligopeptides as Polynucleotide Analogs

  摘要：

  Several dipeptides which have a uracil moiety in their side chains were designed as nucleotide analogs. Oligopeptides obtained from the dipeptides as monomer units were water-soluble, but exhibited no hypochromic effect with poly A or poly dA.

  DOI：

  10.1080/07328319608002398
• 作为产物：
  描述：

  methyl 4-(β-methoxyacrylamidocarbonylamino)-1-(tosylamino)butyrate 在 sodium hydroxide 、 氢溴酸 、 溶剂黄146 作用下， 反应 31.0h， 生成 1-(3'-氨基-3'-羧基丙基)尿嘧啶
  参考文献：
  名称：

  Synthesis of Oligopeptides as Polynucleotide Analogs

  摘要：

  Several dipeptides which have a uracil moiety in their side chains were designed as nucleotide analogs. Oligopeptides obtained from the dipeptides as monomer units were water-soluble, but exhibited no hypochromic effect with poly A or poly dA.

  DOI：

  10.1080/07328319608002398

文献信息

• Synthesis of Oligopeptides as Polynucleotide Analogs
  作者：Hiroki Umemiya、Hiroyuki Kagechika、Yuichi Hashimoto、Koichi Shudo

  DOI：10.1080/07328319608002398

  日期：1996.1

  Several dipeptides which have a uracil moiety in their side chains were designed as nucleotide analogs. Oligopeptides obtained from the dipeptides as monomer units were water-soluble, but exhibited no hypochromic effect with poly A or poly dA.