4-(6-Benzyloxycarbonylamino-hexanoylamino)-4-[2-(2,5-dioxo-pyrrolidin-1-yloxycarbonyl)-ethyl]-heptanedioic acid bis-(2,5-dioxo-pyrrolidin-1-yl) ester | 880359-80-8

• 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: 4-(6-Benzyloxycarbonylamino-hexanoylamino)-4-[2-(2,5-dioxo-pyrrolidin-1-yloxycarbonyl)-ethyl]-heptanedioic acid bis-(2,5-dioxo-pyrrolidin-1-yl) ester
• CAS: 880359-80-8
• 化学式: C₃₆H₄₃N₅O₁₅
• 分子量: 785.762
• InChiKey: YZJZJENKXCZOEW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.49
• 重原子数：
  56.0
• 可旋转键数：
  21.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  258.47
• 氢给体数：
  2.0
• 氢受体数：
  15.0

反应信息

• 作为反应物：
  描述：

  4-(6-Benzyloxycarbonylamino-hexanoylamino)-4-[2-(2,5-dioxo-pyrrolidin-1-yloxycarbonyl)-ethyl]-heptanedioic acid bis-(2,5-dioxo-pyrrolidin-1-yl) ester 在 氢溴酸 、 溶剂黄146 、 三乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 14.75h， 生成
  参考文献：
  名称：

  Chemiluminescent acridinium-9-carboxamide boronic acid probes: Application to a homogeneous glycated hemoglobin assay

  摘要：

  Chemiluminescent acridinium-9-carboxamide probes containing 1, 3, 9, and 27 phenylboronic acids were prepared and their chemiluminescent properties evaluated. The relative chemiluminescent signal from the probes varied from 4 to 0.83 x 10(19) counts/mol across the series, while the apparent affinity of the probes for the diabetes marker glycated hemoglobin increased from 211 to 0.43 mu M. The dose-dependent modulation of the chemiluminescent intensity of the probes upon binding was used to demonstrate a homogeneous assay for glycated hemoglobin. (C) 2006 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2005.11.062
• 作为产物：
  描述：

  Ditert-butyl 4-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-4-[6-(phenylmethoxycarbonylamino)hexanoylamino]heptanedioate 在 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 、 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 16.0h， 生成 4-(6-Benzyloxycarbonylamino-hexanoylamino)-4-[2-(2,5-dioxo-pyrrolidin-1-yloxycarbonyl)-ethyl]-heptanedioic acid bis-(2,5-dioxo-pyrrolidin-1-yl) ester
  参考文献：
  名称：

  Chemiluminescent acridinium-9-carboxamide boronic acid probes: Application to a homogeneous glycated hemoglobin assay

  摘要：

  Chemiluminescent acridinium-9-carboxamide probes containing 1, 3, 9, and 27 phenylboronic acids were prepared and their chemiluminescent properties evaluated. The relative chemiluminescent signal from the probes varied from 4 to 0.83 x 10(19) counts/mol across the series, while the apparent affinity of the probes for the diabetes marker glycated hemoglobin increased from 211 to 0.43 mu M. The dose-dependent modulation of the chemiluminescent intensity of the probes upon binding was used to demonstrate a homogeneous assay for glycated hemoglobin. (C) 2006 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmcl.2005.11.062