Bridging cheminformatic metabolite prediction and tandem mass spectrometry
β Scribed by M. Reza Anari; Thomas A. Baillie
- Book ID
- 114385064
- Publisher
- Elsevier Science
- Year
- 2005
- Tongue
- English
- Weight
- 135 KB
- Volume
- 10
- Category
- Article
- ISSN
- 1359-6446
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π SIMILAR VOLUMES
A method which involves the use of tandem mass spectrometry (MS/MS) for the identification of drug metabolites has been demonstrated with a triple quadrupole mass spectrometer. The method is based on the fact that metabolites usually retain various substructures of the original drug molecule. MS/MS
## Abstract Metabolic activation of a drug leading to reactive metabolite(s) that can covalently modify proteins is considered an initial step that may lead to drugβinduced organ toxicities. Characterization of reactive metabolites is critical to designing new drug candidates with an improved toxic