Products 127000-20-8

CAS 127000-20-8 is the registry number for Gadobenate Dimeglumine. Offered by: Chemat Brand. Available pack sizes: on request.

Gadobenate Dimeglumine
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

2-[2-[carboxylatomethyl-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl]amino]ethyl-(carboxymethyl)amino]-3-phenylmethoxypropanoate;gadolinium(3+);bis((2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol) (CAS 127000-20-8) is a chemical compound with the molecular formula C36H62GdN5O21 and a molecular weight of 1058.1 g/mol. IUPAC name: 2-[2-[carboxylatomethyl-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl]amino]ethyl-(carboxymethyl)amino]-3-phenylmethoxypropanoate;gadolinium(3+);bis((2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol). InChIKey: OCDAWJYGVOLXGZ-VPVMAENOSA-K.

Identity
Molecular formulaC36H62GdN5O21
Molecular weight1058.1 g/mol
IUPAC name2-[2-[carboxylatomethyl-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl]amino]ethyl-(carboxymethyl)amino]-3-phenylmethoxypropanoate;gadolinium(3+);bis((2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol)
InChIKeyOCDAWJYGVOLXGZ-VPVMAENOSA-K
SMILESCNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O.C1=CC=C(C=C1)COCC(C(=O)[O-])N(CCN(CCN(CC(=O)O)CC(=O)[O-])CC(=O)[O-])CC(=O)O.[Gd+3]

Computed by PubChem (NCBI)

Synonyms: Gadobenate dimeglumine, Gd-Bopta/dimeg, Multihance, Gadobenic acid dimeglumine salt, Multihance Multipack, Gadobenate Meglumine, Gadobenic acid meglumine, Gadobenoate dimeglumine