2'-脱氧胞苷-5'-磷酸二钠 | 155390-68-4

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘧啶核苷酸
• 中文名称: 2'-脱氧胞苷-5'-磷酸二钠
• 中文别名: 2′-脱氧胞苷-5′-磷酸二钠盐；2'-脱氧胞苷-5'-单磷酸二钠;；脱氧胞苷酸二钠；2'-脱氧胞苷单磷酸二钠盐；2'-脱氧胞苷5'-单磷酸钠盐；2'-脱氧胞苷-5'-单磷酸二钠盐；2"-脱氧胞苷-5"-磷酸二钠；2'-脱氧胞苷 5'-单磷酸钠盐；dCMP.Na2；2'-脱氧胞苷-5'-单磷酸二钠
• 英文名称: 2'-deoxycytidine-5'-monophosphate sodium salt
• 英文别名: cytidine monophosphate monosodium salt；2′-deoxycytidine 5′-monophosphate；dCMP；2'-deoxycytidine 5'-monophosphate；dCMP sodium salt；5'-dCMP；sodium;1-[(2R,4S,5R)-4-hydroxy-5-(phosphonooxymethyl)oxolan-2-yl]-4-iminopyrimidin-2-olate
• CAS: 155390-68-4
• 化学式: C₉H₁₃N₃O₇P*Na
• 分子量: 329.182
• InChiKey: VEYOKIFAUDNJOH-OERIEOFYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -5.04
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  158
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  2'-脱氧胞苷-5'-磷酸二钠 在 copper(II) sulfate 、 sodium ascorbate 作用下， 以 甲苯 为溶剂， 反应 20.08h， 生成 N³-((2-hydroxyethyl)-1H-1,2,3-triazol-4-yl)methyl-2′-deoxycytidine-5′-monophosphate
  参考文献：
  名称：

  Synthesis of New Alkylated Mononucleotide Analogues and Their Repair Proficiency by the Prokaryotic DNA Repair Protein AlkB

  摘要：

  We describe the synthesis of a variety of new alkylated mononucleotides and examine their repair proficiency with the prokaryotic direct DNA repair protein AlkB. A comparison of rates of repair among the different substrates supports the currently accepted radical mechanism.

  DOI：

  10.1055/s-0035-1560491
• 作为产物：
  描述：

  N³-(octa-2,6-diynyl)-2′-deoxycytidine-5′-monophosphate 在 AlkB protein in Escherichia coli 、 potassium chloride 、 2-氧代-戊二酸离子(2-) 、 iron(II) sulfate 、 sodium ascorbate 、 1,4-二巯基-2,3-丁二醇 、 bovine serum albumin 作用下， 以 aq. buffer 为溶剂， 生成 2'-脱氧胞苷-5'-磷酸二钠
  参考文献：
  名称：

  Synthesis of New Alkylated Mononucleotide Analogues and Their Repair Proficiency by the Prokaryotic DNA Repair Protein AlkB

  摘要：

  We describe the synthesis of a variety of new alkylated mononucleotides and examine their repair proficiency with the prokaryotic direct DNA repair protein AlkB. A comparison of rates of repair among the different substrates supports the currently accepted radical mechanism.

  DOI：

  10.1055/s-0035-1560491

文献信息

• Synthesis of New Alkylated Mononucleotide Analogues and Their Repair Proficiency by the Prokaryotic DNA Repair Protein AlkB
  作者：Dennis Gillingham、Kiril Tishinov

  DOI：10.1055/s-0035-1560491

  日期：——

  We describe the synthesis of a variety of new alkylated mononucleotides and examine their repair proficiency with the prokaryotic direct DNA repair protein AlkB. A comparison of rates of repair among the different substrates supports the currently accepted radical mechanism.