Chemical Compound

Gadobutrol

CAS Registry Number 770691-21-9
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Gadobutrol chemical structure
Primary Record

Gadobutrol

In stock
6,197 g
Purity
98.5 %
CAS
770691-21-9

Compound Identifiers & Properties

CAS
770691-21-9
PubChem CID
169440860
SMILES
C1CN(CCN(CCN(CCN1CC(=O)[O-])CC(=O)[O-])[C@H](CO)[C@@H](CO)O)CC(=O)[O-].[Gd+3]
Canonical SMILES
O=C([O-])CN1CCN(CC(=O)[O-])CCN([C@H](CO)[C@H](O)CO)CCN(CC(=O)[O-])CC1.[Gd+3]

Names & Synonyms

  • Gadobutrol
  • 770691-21-9
  • Gadolinium, [rel-10-[(2R,3S)-2-(hydroxy-?O)-3-hydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetato(3-)-?N1,?N4,?N7,?N10,?O1,?O4,?O7]-, (SA-8-1425362'5')-; Gadolinium, [10-[2-(hydroxy-?O)-3-hydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetato(3-)-?N1,?N4,?N7,?N10,?O1,?O4,?O7]-, [SA-8-1425362'5'-(R*,S*)]-; Gadobutrol; Gadograf; Gadovist; Protovist; ZK 135079