Boc-His(Boc)-Gly-OH | 270907-50-1

• 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
• 英文名称: Boc-His(Boc)-Gly-OH
• CAS: 270907-50-1
• 化学式: C₁₈H₂₈N₄O₇
• 分子量: 412.443
• InChiKey: SCZUPFQUPPNUPY-LBPRGKRZSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  29.0
• 可旋转键数：
  6.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  148.85
• 氢给体数：
  3.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  Boc-His(Boc)-Gly-OH 在 (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate 、 三氟乙酸 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 12.0h， 生成 (2S)-2-amino-N-[2-[[3,5-bis[[[2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]methyl]phenyl]methylamino]-2-oxoethyl]-3-(1H-imidazol-5-yl)propanamide
  参考文献：
  名称：

  Recognition of Flexible Peptides in Water by Transition Metal Complexes

  摘要：

  [GRAPHICS]This paper describes the design, synthesis, and evaluation of transition metal complexes capable of recognizing flexible histidine-containing peptides in aqueous medium (25 mM HEPES buffer, pH = 7.0, 25 degrees C). When the pattern of metal ions on a complex matches with the pattern of histidine moieties on the peptide, strong interaction (K = 1.2 x 10(6) M-1) can be achieved. The complex was highly selective (>200:1) in discriminating similar flexible peptides differing only by one glycine unit.

  DOI：

  10.1021/ol005555d
• 作为产物：
  描述：

  Boc-His(Boc)-OH 在 钯 氢气 、 (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate 作用下， 以 甲醇 、 乙腈 为溶剂， 反应 16.0h， 生成 Boc-His(Boc)-Gly-OH
  参考文献：
  名称：

  Recognition of Flexible Peptides in Water by Transition Metal Complexes

  摘要：

  [GRAPHICS]This paper describes the design, synthesis, and evaluation of transition metal complexes capable of recognizing flexible histidine-containing peptides in aqueous medium (25 mM HEPES buffer, pH = 7.0, 25 degrees C). When the pattern of metal ions on a complex matches with the pattern of histidine moieties on the peptide, strong interaction (K = 1.2 x 10(6) M-1) can be achieved. The complex was highly selective (>200:1) in discriminating similar flexible peptides differing only by one glycine unit.

  DOI：

  10.1021/ol005555d

文献信息

• The synthesis of immunomodulating peptide alloferon, the active principle of antiviral drug allokine-alpha
  作者：M. V. Sidorova、A. S. Molokoedov、E. V. Kudryavtseva、M. I. Baldin、D. A. Frid、M. V. Ovchinnikov、Zh. D. Bespalova、V. N. Bushuev

  DOI：10.1134/s1068162006020051

  日期：2006.3

  Two variants of the synthesis of tridecapeptide alloferon, the active principle of antiviral preparation allokine-alpha, were developed on the basis of fragment condensation in solution or on the Merrifield resin. The solid phase variant of the synthesis was shown to be more technological; it allows the preparation of the product at a higher total yield (40% vs. 17% for conventional synthesis in solution from the starting derivatives of the C-terminal dipeptide). The by-products formed during the synthesis of alloferon were identified.