Structure via PubChem · Public domain (PubChem)
gadobenic acid
Sign in to saveAlso known as 113662-23-0, Acidum gadobenicum, Gadobenate, Acide gadobenique, Acido gadobenico, Gadobensäure
complex of gadolinium by a chelating agent derived from DTPA
Chemical data
- Formula
- C22H28GdN3O11
- Molecular weight
- 667.7 g/mol
- IUPAC name
- 2-[2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxymethyl)amino]ethyl-(carboxymethyl)amino]-3-phenylmethoxypropanoate;gadolinium(3+)
- SMILES
- 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
- Polar surface area
- 214 Ų
- H-bond donors
- 2
- H-bond acceptors
- 14
- Formal charge
- 0
via PubChem
Research
1,025 papers- Gadolinium-Induced Fibrosis.Annual review of medicine · 2016
- Gadoxetic acid-enhanced MRI for the characterization of hepatocellular carcinoma: A systematic review and meta-analysis.Journal of magnetic resonance imaging : JMRI · 2017
- Focal nodular hyperplasia.European journal of radiology · 2006
- Hepatobiliary contrast agents for Liver Magnetic Resonance Imaging.Radiologia · 2024
- Pilot study: A simple CAD-based tool to detect breast cancer on MRI of the breast.Magnetic resonance imaging · 2024
via PubMed
Wikidata facts
- Subclass of
- chemical compound
- Mass
- 668.096488
Show 3 more facts
- chemical formula
- C₂₂H₂₈GdN₃O₁₁
- canonical SMILES
- 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]
- subject has role
- contrast agent
Sources (1)
via Wikidata · CC0
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via Wikidata sitelinks · CC0