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gadobenate

PubChem CID 18177388· C22H28GdN3O11

Molecular formula
C22H28GdN3O11
Molecular weight
667.7 g/mol
IUPAC name
2-[2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]-3-phenylmethoxypropanoate;gadolinium(3+);hydron
SMILES
[H+].[H+].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]
InChIKey
MXZROTBGJUUXID-UHFFFAOYSA-K