92943-93-6 (钆特酸葡甲胺,Gadolinium Dota Meglumine)

CAS号:
92943-93-6
中文名称:
钆特酸葡甲胺
英文名称:
Gadolinium Dota Meglumine

钆特酸葡甲胺(92943-93-6)名称与标识符

名称

中文别名:
多它灵;钆特酸葡胺;钆特酸葡甲胺;轧特酸葡胺;钆特酸葡甲胺:多它灵;多他灵;钆特酸葡甲胺/钆特酸普胺;钆特酸葡胺,多它灵;它多灵;
英文别名:
Gadolinium 2,2',2''-[10-(carboxymethyl)-1,4,7,10-tetraazacyclodod ecane-1,4,7-triyl]triacetate - 1-deoxy-1-(methylamino)-D-glucitol (1:1:1);Dotarem;Gadolinium-DOTA meglumine;Gd-DOTA meglumine;Magnescope;P 449;Gadoterate Meglumin;gadolinium DOTA meglumine;D-Glucitol, 1-deoxy-1-(methylamino)-, [1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetato(4-)-kN1,kN4,kN7,kN10,kO1,kO4,kO7,kO10]gadolinate(1-) (1:1);Gadoteric acid meglumine salt;gadolinium 2,2',2''-[10-(carboxymethyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl]triacetate - 1-deoxy-1-(methylamino)-D-glucitol (1:1);

标识符

InChIKey:
RYHQMKVRYNEBNJ-BMWGJIJESA-K
Inchi:
1S/C16H28N4O8.C7H17NO5.Gd/c21-13(22)9-17-1-2-18(10-14(23)24)5-6-20(12-16(27)28)8-7-19(4-3-17)11-15(25)26;1-8-2-4(10)6(12)7(13)5(11)3-9;/h1-12H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28);4-13H,2-3H2,1H3;/q;;+3/p-3/t;4-,5+,6+,7+;/m.0./s1
SMILES:
[C@@H](O)([C@@H](O)CNC)[C@H](O)[C@H](O)CO.O=C1CN23CCN45CCN67CCN8(CC2)CC(=O)[O-][Gd+3]3486([O-]C(=O)C5)([O-]C(=O)C7)[O-]1.[H+]

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