(11-Methoxycarbonylmethyl-2-methyl-6,7,10,11,17,18-hexahydro-9H-8,16,19-trioxa-5,11-diaza-dibenzo[a,g]cyclopentadecen-5-yl)-acetic acid methyl ester | 481666-72-2

• 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: (11-Methoxycarbonylmethyl-2-methyl-6,7,10,11,17,18-hexahydro-9H-8,16,19-trioxa-5,11-diaza-dibenzo[a,g]cyclopentadecen-5-yl)-acetic acid methyl ester
• 英文别名: Methyl 2-[18-(2-methoxy-2-oxoethyl)-8-methyl-2,5,15-trioxa-12,18-diazatricyclo[17.4.0.06,11]tricosa-1(23),6(11),7,9,19,21-hexaen-12-yl]acetate
• CAS: 481666-72-2
• 化学式: C₂₅H₃₂N₂O₇
• 分子量: 472.538
• InChiKey: XHZFEZPJSJIBER-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  86.8
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  (11-Methoxycarbonylmethyl-2-methyl-6,7,10,11,17,18-hexahydro-9H-8,16,19-trioxa-5,11-diaza-dibenzo[a,g]cyclopentadecen-5-yl)-acetic acid methyl ester 在 硫酸氢甲酯 、 三氯氧磷 作用下， 反应 3.0h， 生成 [2-(2,7-Difluoro-3,6-dihydroxy-9H-xanthen-9-yl)-11-methoxycarbonylmethyl-14-methyl-6,7,10,11,17,18-hexahydro-9H-8,16,19-trioxa-5,11-diaza-dibenzo[a,g]cyclopentadecen-5-yl]-acetic acid methyl ester
  参考文献：
  名称：

  Fluorescent sodium ion indicators based on the 1,7-diaza-15-crown-5 system

  摘要：

  A series of novel sodium ion-sensitive fluorescent reagents suitable for biological applications is described. The chelator nitrogen atom substituents affect the selectivity and affinity of cation binding, while the nature of the fluorophore determines the type of fluorescent response to metal ion chelation. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.08.022
• 作为产物：
  描述：

  2-Methyl-17,18-dihydro-5H,11H-8,16,19-trioxa-5,11-diaza-dibenzo[a,g]cyclopentadecene-6,10-dione 在 硼烷 、 N,N-二异丙基乙胺 、 sodium iodide 作用下， 以 四氢呋喃 、 乙腈 为溶剂， 生成 (11-Methoxycarbonylmethyl-2-methyl-6,7,10,11,17,18-hexahydro-9H-8,16,19-trioxa-5,11-diaza-dibenzo[a,g]cyclopentadecen-5-yl)-acetic acid methyl ester
  参考文献：
  名称：

  Fluorescent sodium ion indicators based on the 1,7-diaza-15-crown-5 system

  摘要：

  A series of novel sodium ion-sensitive fluorescent reagents suitable for biological applications is described. The chelator nitrogen atom substituents affect the selectivity and affinity of cation binding, while the nature of the fluorophore determines the type of fluorescent response to metal ion chelation. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.08.022

文献信息

• CROWN ETHER DERIVATIVES
  申请人：GEE R. Kyle

  公开号：US20070043212A1

  公开（公告）日：2007-02-22

  The invention describes crown ether chelaters including crown ethers having the formula:

  该发明描述了包括具有以下式的冠醚配体的冠醚： Formula:（公式无法在此显示）
• [EN] CROWN ETHER DERIVATIVES<br/>[FR] DÉRIVÉS D'ÉTHER COURONNE
  申请人：MOLECULAR PROBES INC

  公开号：WO2005016874A3

  公开（公告）日：2005-11-17
• US7579463B2
  申请人：——

  公开号：US7579463B2

  公开（公告）日：2009-08-25
• US7989617B2
  申请人：——

  公开号：US7989617B2

  公开（公告）日：2011-08-02
• Fluorescent sodium ion indicators based on the 1,7-diaza-15-crown-5 system
  作者：Vladimir V. Martin、Anca Rothe、Zhenjun Diwu、Kyle R. Gee

  DOI：10.1016/j.bmcl.2004.08.022

  日期：2004.11

  A series of novel sodium ion-sensitive fluorescent reagents suitable for biological applications is described. The chelator nitrogen atom substituents affect the selectivity and affinity of cation binding, while the nature of the fluorophore determines the type of fluorescent response to metal ion chelation. (C) 2004 Elsevier Ltd. All rights reserved.