二乙烯三胺五乙酸-1-羟基-3-氨基丙烷-1,1-二膦酸钆
[CAS# 133019-01-9]

基本信息

• 产品名称: 二乙烯三胺五乙酸-1-羟基-3-氨基丙烷-1,1-二膦酸钆
• 英文名: Gadolinium Dtpa-1-hydroxy-3-aminopropane-1,1-diphosphonate
• 别名: Gadolinium(+3) Cation; Hydron; 2-[2-[2-[[2-[(3-Hydroxy-3,3-Diphosphonato-Propyl)Amino]-2-Oxo-Ethyl]-(2-Oxido-2-Oxo-Ethyl)Amino]Ethyl-(2-Oxido-2-Oxo-Ethyl)Amino]Ethyl-(2-Oxido-2-Oxo-Ethyl)Amino]Acetate; Gadolinium(+3) Cation; Hydron; 2-[2-[2-[[2-[(3-Hydroxy-3,3-Diphosphonato-Propyl)Amino]-2-Keto-Ethyl]-(2-Keto-2-Oxido-Ethyl)Amino]Ethyl-(2-Keto-2-Oxido-Ethyl)Amino]Ethyl-(2-Keto-2-Oxido-Ethyl)Amino]Acetate
• 分子式: C₁₇H₂₉GdN₄O₁₆P₂
• 分子量: 764.63
• CAS 登录号: 133019-01-9
• 分子行输入简码 SMILES: [Gd+3].[H+].[H+].[H+].[H+].[H+].C(C([P]([O-])([O-])=O)([P]([O-])([O-])=O)O)CNC(=O)CN(CCN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O)CC([O-])=O
• 国际化学标识码 InChI: 1S/C17H32N4O16P2.Gd/c22-12(18-2-1-17(31,38(32,33)34)39(35,36)37)7-20(9-14(25)26)5-3-19(8-13(23)24)4-6-21(10-15(27)28)11-16(29)30;/h31H,1-11H2,(H,18,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30)(H2,32,33,34)(H2,35,36,37);/q;+3/p-3
• 国际化学标识检索码 InChIKey: WVZSYPBNCUZLCL-UHFFFAOYSA-K