7228-78-6 Purity
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Specification
The molecular formula of gadoteric acid is C16H25GdN4O8.
The molecular weight of gadoteric acid is 558.6 g/mol.
The IUPAC name of gadoteric acid is 2-[4,7-bis(carboxylatomethyl)-10-(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate; gadolinium(3+).
Gadoteric acid enhances the relaxation rates of water protons in its vicinity, leading to an increase in signal intensity of tissues, which allows for imaging of blood vessels and inflamed or diseased tissue.
The InChIKey of gadoteric acid is GFSTXYOTEVLASN-UHFFFAOYSA-K.
The Canonical SMILES of gadoteric acid is C1CN(CCN(CCN(CCN1CC(=O)O)CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Gd+3].
The CAS number of gadoteric acid is 72573-82-1.
The hydrogen bond donor count of gadoteric acid is 1.
Gadoteric acid has 12 hydrogen bond acceptors.
The topological polar surface area of gadoteric acid is 171 Å2.