D-glucose 6-(sodium hydrogenphosphate) | 84332-92-3

• 物质功能分类: 生物化工 - 糖类化合物
• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: D-glucose 6-(sodium hydrogenphosphate)
• 英文别名: β-D-glucose-6-phosphate monosodium salt；sodium β-D-glucose-6-monophosphate；β-D-glucopyranose-6-phosphate monosodium salt；beta-D-Glucose 6-phosphate sodium salt；sodium;[(2R,3S,4S,5R,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl hydrogen phosphate
• CAS: 84332-92-3
• 化学式: C₆H₁₂O₉P*Na
• 分子量: 282.119
• InChiKey: ZALKNDISPIVVKC-WYRLRVFGSA-M

物化性质

• 熔点：
  204 °C (dec.)(lit.)
• 溶解度：
  H2O：50 mg/mL，透明，无色至微黄色

计算性质

• 辛醇/水分配系数(LogP)：
  -6.73
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  160
• 氢给体数：
  5
• 氢受体数：
  9

安全信息

• WGK Germany：
  3

反应信息

• 作为反应物：
  描述：

  N,N'-4,4'-bis(benzyl-5-fluoro-2-boronic acid)bipyridinium dibromide 、 D-glucose 6-(sodium hydrogenphosphate) 在 4-羟乙基哌嗪乙磺酸 作用下， 以 重水 为溶剂， 反应 10.0h， 生成
  参考文献：
  名称：

  Fluorinated Boronic Acid-Appended Bipyridinium Salts for Diol Recognition and Discrimination via ¹⁹F NMR Barcodes

  摘要：

  Fluorinated boronic acid-appended benzyl bipyridinium salts, derived from 4,4'-, 3,4'-, and 3,3'-bipyridines, were synthesized and used to detect and differentiate diol-containing analytes at physiological conditions via F-19 NMR spectroscopy. An array of three water-soluble boronic acid receptors in combination with F-19 NMR spectroscopy discriminates nine diol-containing bioanalytes-catechol, dopamine, fructose, glucose, glucose-1-phosphate, glucose-6-phosphate, galactose, lactose, and sucrose-at low mM concentrations. Characteristic NMR fingerprints are interpreted as two-dimensional barcodes without the need of multivariate analysis techniques.

  DOI：

  10.1021/jacs.5b10934

文献信息

• Fluorinated Boronic Acid-Appended Bipyridinium Salts for Diol Recognition and Discrimination via ¹⁹F NMR Barcodes
  作者：Jörg Axthelm、Helmar Görls、Ulrich S. Schubert、Alexander Schiller

  DOI：10.1021/jacs.5b10934

  日期：2015.12.16

  Fluorinated boronic acid-appended benzyl bipyridinium salts, derived from 4,4'-, 3,4'-, and 3,3'-bipyridines, were synthesized and used to detect and differentiate diol-containing analytes at physiological conditions via F-19 NMR spectroscopy. An array of three water-soluble boronic acid receptors in combination with F-19 NMR spectroscopy discriminates nine diol-containing bioanalytes-catechol, dopamine, fructose, glucose, glucose-1-phosphate, glucose-6-phosphate, galactose, lactose, and sucrose-at low mM concentrations. Characteristic NMR fingerprints are interpreted as two-dimensional barcodes without the need of multivariate analysis techniques.