Cargando…

Physicochemical Prediction of Metabolite Fragmentation in Tandem Mass Spectrometry

Current bottleneck of comprehensive non-target metabolite identification is insufficient spectral library. Many research groups have tried to build a theoretical product ion spectral library independent of measurement condition or settings, but mechanisms of metabolite fragmentation are not fully cl...

Descripción completa

Detalles Bibliográficos
Autores principales:	Tanaka, Wataru, Arita, Masanori
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Mass Spectrometry Society of Japan 2018
Materias:	Original Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6002374/ https://www.ncbi.nlm.nih.gov/pubmed/29922568 http://dx.doi.org/10.5702/massspectrometry.A0066

Ejemplares similares

Comprehensive identification of sphingolipid species by in silico retention time and tandem mass spectral library
por: Tsugawa, Hiroshi, et al.
Publicado: (2017)

A Fragmentation Study on Four Oligostilbenes by Electrospray Tandem Mass Spectrometry
por: Zhang, Chen-Chen, et al.
Publicado: (2019)

Measurement of kynurenine pathway metabolites by tandem mass spectrometry
por: Abusoglu, Sedat, et al.
Publicado: (2023)

Analysis of Isotopic Labeling in Peptide Fragments by Tandem Mass Spectrometry
por: Allen, Doug K., et al.
Publicado: (2014)

Gas-Phase Fragmentation of Cyclic Oligosaccharides in Tandem Mass Spectrometry
por: Chizhov, Alexander O., et al.
Publicado: (2019)

Mass Spectrometry Data Repository Enhances Novel Metabolite Discoveries with Advances in Computational Metabolomics
por: Tsugawa, Hiroshi, et al.
Publicado: (2019)

Structural Investigation of Betulinic Acid Plasma Metabolites by Tandem Mass Spectrometry
por: Ghiulai, Roxana, et al.
Publicado: (2022)

Combined Liquid Chromatography–Tandem Mass Spectrometry Analysis of Progesterone Metabolites
por: Sinreih, Maša, et al.
Publicado: (2015)

A Derivative Method with Free Radical Oxidation to Predict Resveratrol Metabolites by Tandem Mass Spectrometry
por: Liu, Wangta, et al.
Publicado: (2015)

ProbSeq—A Fragmentation Model for Interpretation of Electrospray Tandem Mass Spectrometry Data
por: Skilling, John, et al.
Publicado: (2004)

Characterization of protein N-glycosylation by tandem mass spectrometry using complementary fragmentation techniques
por: Ford, Kristina L., et al.
Publicado: (2015)

Investigation of the Influence of Charge State and Collision Energy on Oligonucleotide Fragmentation by Tandem Mass Spectrometry
por: Gawlig, Christopher, et al.
Publicado: (2023)

Gas-Phase Fragmentation Reactions of Protonated Cystine using High-Resolution Tandem Mass Spectrometry
por: Zhang, Pengwei, et al.
Publicado: (2019)

Simultaneous Quantification of Multiple Urinary Naphthalene Metabolites by Liquid Chromatography Tandem Mass Spectrometry
por: Ayala, Daniel C., et al.
Publicado: (2015)

A Fragmentation Study on Four Unusual Secoiridoid Trimers, Swerilactones H–K, by Electrospray Tandem Mass Spectrometry
por: Geng, Chang-An, et al.
Publicado: (2016)

Differential annotation of converted metabolites (DAC-Met): Exploration of Maoto (Ma-huang-tang)-derived metabolites in plasma using high-resolution mass spectrometry
por: Ohbuchi, Katsuya, et al.
Publicado: (2020)

Analysis of mononucleotides by tandem mass spectrometry: investigation of fragmentation pathways for phosphate- and ribose-modified nucleotide analogues
por: Strzelecka, Dominika, et al.
Publicado: (2017)

Metabolite Profiling and Quantitation of Cucurbitacins in Cucurbitaceae Plants by Liquid Chromatography coupled to Tandem Mass Spectrometry
por: Ul Haq, Faraz, et al.
Publicado: (2019)

Two-dimensional mass spectrometry: new perspectives for tandem mass spectrometry
por: van Agthoven, Maria A., et al.
Publicado: (2019)

Concentration determination of urinary metabolites of N,N-dimethylacetamide by high-performance liquid chromatography-tandem mass spectrometry
por: Yamamoto, Shinobu, et al.
Publicado: (2017)

Simultaneous determination of sarcosine and its related metabolites by gas chromatography-tandem mass spectrometry for prostate cancer diagnosis
por: Yamkamon, Vichanan, et al.
Publicado: (2018)

Progressive search in tandem mass spectrometry
por: Joh, Yoonsung, et al.
Publicado: (2023)

Blood carnitine profiling on tandem mass spectrometry in liver cirrhotic patients
por: Miyaaki, Hisamitsu, et al.
Publicado: (2020)

Computational refinement of post-translational modifications predicted from tandem mass spectrometry
por: Chung, Clement, et al.
Publicado: (2011)

Delivery prediction by quantitative analysis of four steroid metabolites with liquid chromatography tandem mass spectrometry in asymptomatic pregnant women
por: Meng, Lanlan, et al.
Publicado: (2022)

Data for analysis of catechol estrogen metabolites in human plasma by liquid chromatography tandem mass spectrometry
por: Denver, Nina, et al.
Publicado: (2019)

Characterization of Metabolites of Leonurine (SCM-198) in Rats after Oral Administration by Liquid Chromatography/Tandem Mass Spectrometry and NMR Spectrometry
por: Zhu, Qing, et al.
Publicado: (2014)

In Search of Disentanglement in Tandem Mass Spectrometry Datasets
por: Abram, Krzysztof Jan, et al.
Publicado: (2023)

Simple method to detect triclofos and its metabolites in plasma of children by combined use of liquid chromatography tandem-mass spectrometry and gas chromatography-mass spectrometry
por: Sato, Hirotaka, et al.
Publicado: (2019)

Simultaneous quantitation of atorvastatin and its two active metabolites in human plasma by liquid chromatography/(–) electrospray tandem mass spectrometry
por: Partani, Pankaj, et al.
Publicado: (2014)

Derivatization enhances analysis of estrogens and their bioactive metabolites in human plasma by liquid chromatography tandem mass spectrometry
por: Denver, Nina, et al.
Publicado: (2019)

Developments in tandem ion mobility mass spectrometry
por: Eldrid, Charles, et al.
Publicado: (2020)

Fast and Sensitive Quantification of Δ(9)-Tetrahydrocannabinol and Its Main Oxidative Metabolites by Liquid Chromatography/Tandem Mass Spectrometry
por: Vozella, Valentina, et al.
Publicado: (2019)

Comprehensive and accurate tracking of carbon origin of LC-tandem mass spectrometry collisional fragments for (13)C-MFA
por: Kappelmann, Jannick, et al.
Publicado: (2017)

High-resolution tandem mass spectrometry dataset reveals fragmentation patterns of cardiac glycosides in leaves of the foxglove plants
por: Ravi, Baradwaj Gopal, et al.
Publicado: (2020)

Method development and validation of ursodiol and its major metabolites in human plasma by HPLC-tandem mass spectrometry
por: Pinto, Márcio Cardoso, et al.
Publicado: (2019)

Liquid chromatography–tandem mass spectrometry metabolic profiling of nazartinib reveals the formation of unexpected reactive metabolites
por: Abdelhameed, Ali S., et al.
Publicado: (2019)

Urinary antihypertensive drug metabolite screening using molecular networking coupled to high-resolution mass spectrometry fragmentation
por: van der Hooft, Justin J. J., et al.
Publicado: (2016)

Simultaneous Method for Selected PBDEs and HBCDDs in Foodstuffs Using Gas Chromatography—Tandem Mass Spectrometry and Liquid Chromatography—Tandem Mass Spectrometry
por: Lipičar, Eva, et al.
Publicado: (2022)

Liquid chromatography–tandem mass spectrometry method for simultaneous determination of valproic acid and its ene-metabolites in epilepsy patient plasma()
por: Lu, Huan, et al.
Publicado: (2016)

Cannot write session to /tmp/vufind_sessions/sess_uu98bn9ubaltm6g613nvn6tv1t