Products 770691-21-9

CAS 770691-21-9 appears in our catalog under these names: Gadobutrol, Gadobutrol, >95% (HPLC). Offered by: Chemat Brand, TRC, TargetMol, Biosynth. Available pack sizes: on request, 1g, 250mg, 5g, 2mg, 5mg, 10mg, 25mg.

2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+) (CAS 770691-21-9) is a chemical compound with the molecular formula C18H31GdN4O9 and a molecular weight of 604.7 g/mol. IUPAC name: 2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+). InChIKey: ZPDFIIGFYAHNSK-CTHHTMFSSA-K.

Identity
Molecular formulaC18H31GdN4O9
Molecular weight604.7 g/mol
IUPAC name2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+)
InChIKeyZPDFIIGFYAHNSK-CTHHTMFSSA-K
SMILESC1CN(CCN(CCN(CCN1CC(=O)[O-])CC(=O)[O-])[C@H](CO)[C@@H](CO)O)CC(=O)[O-].[Gd+3]

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