N-benzyloxy-N-(3,4-dihydroxybenzyl)-β-D-glucosylamine | 1185742-44-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N-benzyloxy-N-(3,4-dihydroxybenzyl)-β-D-glucosylamine
• 英文别名: (2R,3R,4S,5S,6R)-2-[(3,4-dihydroxyphenyl)methyl-phenylmethoxyamino]-6-(hydroxymethyl)oxane-3,4,5-triol
• CAS: 1185742-44-2
• 化学式: C₂₀H₂₅NO₈
• 分子量: 407.42
• InChiKey: SGKBFZBORQFPGT-OUUBHVDSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  29
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  143
• 氢给体数：
  6
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  D-葡萄糖 、 4-[(benzyloxyamino)methyl]benzene-1,2-diol 在 溶剂黄146 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 以80%的产率得到N-benzyloxy-N-(3,4-dihydroxybenzyl)-β-D-glucosylamine
  参考文献：
  名称：

  First experimental identification of Ras-inhibitor binding interface using a water-soluble Ras ligand

  摘要：

  By combining in the same molecule Ras-interacting aromatic moieties and a sugar, we prepared a water-soluble Ras ligand that binds Ras and inhibits guanine nucleotide exchange. With this compound it was possible to determine experimentally by a N-15-edited HSQC NMR experiment the ligand-Ras binding interface. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.05.107

文献信息

• First experimental identification of Ras-inhibitor binding interface using a water-soluble Ras ligand
  作者：Alessandro Palmioli、Elena Sacco、Sherwin Abraham、Celestine J. Thomas、Alessandro Di Domizio、Luca De Gioia、Vadim Gaponenko、Marco Vanoni、Francesco Peri

  DOI：10.1016/j.bmcl.2009.05.107

  日期：2009.8

  By combining in the same molecule Ras-interacting aromatic moieties and a sugar, we prepared a water-soluble Ras ligand that binds Ras and inhibits guanine nucleotide exchange. With this compound it was possible to determine experimentally by a N-15-edited HSQC NMR experiment the ligand-Ras binding interface. (C) 2009 Elsevier Ltd. All rights reserved.