6-amino-2-decanoylaminohexanoic acid methyl ester hydrochloride | 95259-38-4

• 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: 6-amino-2-decanoylaminohexanoic acid methyl ester hydrochloride
• CAS: 95259-38-4
• 化学式: C₁₇H₃₄N₂O₃*ClH
• 分子量: 350.93
• InChiKey: FYQVPOBIBWHMKF-RSAXXLAASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.34
• 重原子数：
  23.0
• 可旋转键数：
  14.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  81.42
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  6-amino-2-decanoylaminohexanoic acid methyl ester hydrochloride 、 Fluorescein isothiocyanate 在 三乙胺 作用下， 以 乙醇 为溶剂， 反应 5.0h， 以51%的产率得到2-decanoylamino-6-(3-fluoresceinthioureido)hexanoic acid methyl ester
  参考文献：
  名称：

  Novel membrane-localizing TEMPO derivatives for measurement of cellular oxidative stress at the cell membrane

  摘要：

  Oxidative stress affecting lipid membranes is considered to be closely related to cardiovascular disease and brain ischernia. In this study, we designed and synthesized membrane-localizing TEMPO derivatives and demonstrated that one of these synthesized probes, compound 1, localized and detected oxidative stress in the cell membrane in an endotoxic model of a mouse macrophage-like cell line. Compound I is therefore a potentially useful probe for evaluating oxidative. stress at the cell membrane. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2006.11.040