[Gd(10-[(3-methoxyphenyl)methyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetate)] | 590361-59-4

• 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: [Gd(10-[(3-methoxyphenyl)methyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetate)]
• 英文别名: [Gd(MBzDO3A)]；2-[4,7-Bis(carboxylatomethyl)-10-[(3-methoxyphenyl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+)；2-[4,7-bis(carboxylatomethyl)-10-[(3-methoxyphenyl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+)
• CAS: 590361-59-4
• 化学式: C₂₂H₃₁GdN₄O₇
• 分子量: 620.761
• InChiKey: FORMIWUISLONII-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  -4.33
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  143
• 氢给体数：
  0
• 氢受体数：
  11

反应信息

• 作为产物：
  描述：

  10-[(3-methoxyphenyl)methyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic acid 、 氯化钆 以 水 为溶剂， 生成 [Gd(10-[(3-methoxyphenyl)methyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetate)]
  参考文献：
  名称：

  Terreno, Enzo; Botta, Mauro; Fedeli, Franco, Inorganic Chemistry, 2003, vol. 42, # 16, p. 4891 - 4897

  摘要：

  DOI：

文献信息

• ENHANCED SUBSTRATE IMAGING BY REVERSIBLE BINDING TO A PARAMAGNETIC COMPLEX
  申请人：Bracco Imaging S.p.A.

  公开号：EP1434768A1

  公开（公告）日：2004-07-07
• Enhanced substrate imaging by reversible binding to a paramagnetic complex
  申请人：——

  公开号：US20040258618A1

  公开（公告）日：2004-12-23

  The invention relates to a method for the Magnetic Resonance Imaging and Magnetic Resonance Spectroscopy Imaging of a substrate molecule different from water wherein the NMR signal is enhanced by a reversible binding of the substrate molecule to a paramagnetic chelate complex, as well as to the use of a paramagnetic chelate complex in said method and the pharmaceutical composition for use therein.
• US7608249B2
  申请人：——

  公开号：US7608249B2

  公开（公告）日：2009-10-27
• [EN] ENHANCED SUBSTRATE IMAGING BY REVERSIBLE BINDING TO A PARAMAGNETIC COMPLEX<br/>[FR] IMAGERIE DE SUBSTRAT AMELIOREE PAR LIAISON REVERSIBLE A UN COMPLEXE PARAMAGNETIQUE
  申请人：BRACCO IMAGING SPA

  公开号：WO2003033479A1

  公开（公告）日：2003-04-24

  The invention relates to a method for the Magnetic Resonance Imaging and Magnetic Resonance Spectroscopy Imaging of a substrate molecule different from water wherein the NMR signal is enhanced by a reversible binding of the substrate molecule to a paramagnetic chelate complex, as well as to the use of a paramagnetic chelate complex in said method and the pharmaceutical composition for use therein.
• Terreno, Enzo; Botta, Mauro; Fedeli, Franco, Inorganic Chemistry, 2003, vol. 42, # 16, p. 4891 - 4897
  作者：Terreno, Enzo、Botta, Mauro、Fedeli, Franco、Mondino, Bruna、Milone, Luciano、Aime, Silvio

  DOI：——

  日期：——