Products 138071-82-6

CAS 138071-82-6 appears in our catalog under these names: Gadobutrol, Gadobutrol monomer, Gadavist. Offered by: Chemat Brand, Hubei YoungXin, Biosynth. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, 10g, 5g.

Gadobutrol
Chemat Brand
  • size: on request
  • Variants: 1
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Gadobutrol monomer
Hubei YoungXin
  • size: 10mg, 25mg, 50mg, 100mg
  • Variants: 5
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Gadavist
Biosynth
  • size: 10g, 5g, 25g
  • Variants: 3
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Structural formula: {0} (CAS {1})

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 138071-82-6) 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]

Computed by PubChem (NCBI)

Synonyms: Gadobutrol, Gadograf, Protovist, Gadavist, Gd-DO3A-butriol, gadobutrolum, Protovis, Gadovist, C18H31GdN4O9, Gadobutrol [INN]
Related forms of this compound
2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;gadolinium(3+) C18H31GdN4O9