Gadobutrol

Product Specifications

CAS Number

770691-21-9

Synonyms

Gadolinium, [rel-10-[(2R,3S)-2-(hydroxy-κO)-3-hydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetato(3-)-κN1,κN4,κN7,κN10,κO1,κO4,κO7]-, (SA-8-1425362'5')-; Gadolinium, [10-[2-(hydroxy-κO)-3-hydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetato(3-)-κN1,κN4,κN7,κN10,κO1,κO4,κO7]-, [SA-8-1425362'5'-(R*,S*)]-; Gadobutrol; Gadograf; Gadovist; Protovist; ZK 135079

Hazard Statement

No Data Available

Purity

>95% (HPLC)

Smiles

OC[C@@H](O)[C@@H](CO)N12CCN3(CC(=O)[O-])CCN4(CC(=O)[O-])CCN(CC(=O)[O-])(CC1)[Gd+3]234

Molecular Formula

C18 H31 Gd N4 O9

Molecular Weight

604.71

InChI

InChI=1S/C18H34N4O9.Gd/c23-12-14(15(25)13-24)22-7-5-20(10-17(28)29)3-1-19(9-16(26)27)2-4-21(6-8-22)11-18(30)31;/h14-15,23-25H,1-13H2,(H,26,27)(H,28,29)(H,30,31);/q;+3/p-3/t14-,15-;/m1./s1