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Volumn 44, Issue 7, 2009, Pages 999-1016

Mass defect filter technique and its applications to drug metabolite identification by high-resolution mass spectrometry

Author keywords

Drug metabolites; High resolution mass spectrometry; In vitro and in vivo metabolites; Mass defect filter; Neutral loss filter; Orbitrap; Product ion filter; Reactive metabolites; Time of flight

Indexed keywords

DRUG METABOLITES; HIGH-RESOLUTION MASS SPECTROMETRY; IN VITRO AND IN VIVO METABOLITES; MASS DEFECT FILTER; NEUTRAL LOSS FILTER; ORBITRAP; PRODUCT ION FILTER; REACTIVE METABOLITES; TIME-OF-FLIGHT;

EID: 67650494794     PISSN: 10765174     EISSN: 10969888     Source Type: Journal    
DOI: 10.1002/jms.1610     Document Type: Review
Times cited : (256)

References (79)
  • 2
    • 38949088196 scopus 로고    scopus 로고
    • Metabolism and toxicity of drugs. Two decades of progress in industrial drug metabolism
    • T. A. Baillie. Metabolism and toxicity of drugs. Two decades of progress in industrial drug metabolism. Chemical Research in Toxicology 2008, 21, 129.
    • (2008) Chemical Research in Toxicology , vol.21 , pp. 129
    • Baillie, T.A.1
  • 3
    • 27144529964 scopus 로고    scopus 로고
    • Principles and applications of LC-MS in new drug discovery
    • W. A. Korfmacher. Principles and applications of LC-MS in new drug discovery. Drug Discovery Today 2005, 10, 1357.
    • (2005) Drug Discovery Today , vol.10 , pp. 1357
    • Korfmacher, W.A.1
  • 4
    • 59649106977 scopus 로고    scopus 로고
    • Recent advances in applications of liquid chromatography-tandem mass spectrometry to the analysis of reactive drug metabolites
    • S. Ma, M. Zhu. Recent advances in applications of liquid chromatography-tandem mass spectrometry to the analysis of reactive drug metabolites. Chemico-Biological Interactions 2009, 179, 25.
    • (2009) Chemico-Biological Interactions , vol.179 , pp. 25
    • Ma, S.1    Zhu, M.2
  • 5
    • 33746382906 scopus 로고    scopus 로고
    • Introduction to early in vitro identification of metabolites of new chemical entities in drug discovery and development
    • P. Baranczewski, A. Stanczak, A. Kautiainen, P. Sandin, P. O. Edlund. Introduction to early in vitro identification of metabolites of new chemical entities in drug discovery and development. Pharmacological Research 2006, 58, 341.
    • (2006) Pharmacological Research , vol.58 , pp. 341
    • Baranczewski, P.1    Stanczak, A.2    Kautiainen, A.3    Sandin, P.4    Edlund, P.O.5
  • 8
    • 34547638065 scopus 로고    scopus 로고
    • Quantitation of acrolein-derived 3-hydroxypropylmercapturic acid in human urine by liquid chromatographyatmospheric pressure chemical ionization tandem mass spectrometry: Effects of cigarette smoking
    • S. G. Carmella, M. Chen, Y. Zhang, S. Zhang, D. K. Hatsukami, S. S. Hecht. Quantitation of acrolein-derived 3-hydroxypropylmercapturic acid in human urine by liquid chromatographyatmospheric pressure chemical ionization tandem mass spectrometry: effects of cigarette smoking. Chemical Research in Toxicology 2007, 20, 986.
    • (2007) Chemical Research in Toxicology , vol.20 , pp. 986
    • Carmella, S.G.1    Chen, M.2    Zhang, Y.3    Zhang, S.4    Hatsukami, D.K.5    Hecht, S.S.6
  • 11
    • 49049114287 scopus 로고    scopus 로고
    • Rapid screening of GSH-trapped reactive metabolites by linear ion trap mass spectrometry with isotope pattern-dependent scanning and post-acquisition data mining
    • L. Ma, B. Wen, Q. Ruan, M. Zhu. Rapid screening of GSH-trapped reactive metabolites by linear ion trap mass spectrometry with isotope pattern-dependent scanning and post-acquisition data mining. Chemical Research in Toxicology 2008, 21, 1477.
    • (2008) Chemical Research in Toxicology , vol.21 , pp. 1477
    • Ma, L.1    Wen, B.2    Ruan, Q.3    Zhu, M.4
  • 12
    • 0037131095 scopus 로고    scopus 로고
    • Structural elucidation of metabolites of ritonavir and indinavir by liquid chromatography-mass spectrometry
    • E. Gangl, I. Utkin, N. Gerber, P. Vouros. Structural elucidation of metabolites of ritonavir and indinavir by liquid chromatography-mass spectrometry. Journal of Chromatography. A 2002, 974, 91.
    • (2002) Journal of Chromatography. A , vol.974 , pp. 91
    • Gangl, E.1    Utkin, I.2    Gerber, N.3    Vouros, P.4
  • 13
    • 0842327199 scopus 로고    scopus 로고
    • Integration of knowledge-based metabolic predictions with liquid chromatography data-dependent tandem mass spectrometry for drug metabolism studies: Application to studies on the biotransformation of indinavir
    • M. R. Anari, R. I. Sanchez, R. Bakhtiar, R. B. Franklin, T. A. Baillie. Integration of knowledge-based metabolic predictions with liquid chromatography data-dependent tandem mass spectrometry for drug metabolism studies: application to studies on the biotransformation of indinavir. Analytical Chemistry 2004, 76, 823.
    • (2004) Analytical Chemistry , vol.76 , pp. 823
    • Anari, M.R.1    Sanchez, R.I.2    Bakhtiar, R.3    Franklin, R.B.4    Baillie, T.A.5
  • 14
    • 14744294855 scopus 로고    scopus 로고
    • The combination of liquid chromatography/tandem mass spectrometry and chip-based infusion for improved screening and characterization of drug metabolites
    • R. F. Staack, E. Varesio, G. Hopfgartner. The combination of liquid chromatography/tandem mass spectrometry and chip-based infusion for improved screening and characterization of drug metabolites. Rapid Communications in Mass Spectrometry 2005, 19, 618.
    • (2005) Rapid Communications in Mass Spectrometry , vol.19 , pp. 618
    • Staack, R.F.1    Varesio, E.2    Hopfgartner, G.3
  • 15
    • 55249123849 scopus 로고    scopus 로고
    • Rapid screening and characterization of drug metabolites using a multiple ion monitoring-dependent MS/MS acquisition method on a hybrid triple quadrupole-linear ion trap mass spectrometer
    • M. Yao, L. Ma, W. G. Humphreys, M. Zhu. Rapid screening and characterization of drug metabolites using a multiple ion monitoring-dependent MS/MS acquisition method on a hybrid triple quadrupole-linear ion trap mass spectrometer. Journal of Mass Spectrometry 2008, 43, 1364.
    • (2008) Journal of Mass Spectrometry , vol.43 , pp. 1364
    • Yao, M.1    Ma, L.2    Humphreys, W.G.3    Zhu, M.4
  • 16
    • 0037297379 scopus 로고    scopus 로고
    • Rapid screening and characterization of drug metabolites using a new quadrupole-linear ion trap mass spectrometer
    • G. Hopfgartner, C. Husser, M. Zell. Rapid screening and characterization of drug metabolites using a new quadrupole-linear ion trap mass spectrometer. Journal of Mass Spectrometry 2003, 38, 138.
    • (2003) Journal of Mass Spectrometry , vol.38 , pp. 138
    • Hopfgartner, G.1    Husser, C.2    Zell, M.3
  • 17
    • 0348050555 scopus 로고    scopus 로고
    • A strategy for metabolite identification using triple-quadrupole mass spectrometry with enhanced resolution and accurate mass capability
    • M. Jemal, Z. Ouyang, W. Zhao, M. Zhu, W. W. Wu. A strategy for metabolite identification using triple-quadrupole mass spectrometry with enhanced resolution and accurate mass capability. Rapid Communications in Mass Spectrometry 2003, 17, 2732.
    • (2003) Rapid Communications in Mass Spectrometry , vol.17 , pp. 2732
    • Jemal, M.1    Ouyang, Z.2    Zhao, W.3    Zhu, M.4    Wu, W.W.5
  • 18
    • 27944457524 scopus 로고    scopus 로고
    • Rapid detection and characterization of minor reactive metabolites using stable-isotope trapping in combination with tandem mass spectrometry
    • Z. Yan, N. Maher, R. Torres, G. W. Caldwell, N. Huebert. Rapid detection and characterization of minor reactive metabolites using stable-isotope trapping in combination with tandem mass spectrometry. Rapid Communications in Mass Spectrometry 2005, 19, 3322.
    • (2005) Rapid Communications in Mass Spectrometry , vol.19 , pp. 3322
    • Yan, Z.1    Maher, N.2    Torres, R.3    Caldwell, G.W.4    Huebert, N.5
  • 19
    • 42449117632 scopus 로고    scopus 로고
    • Detection of novel reactive metabolites of trazodone: Evidence for CYP2D6-mediated bioactivation of m-chlorophenylpiperazine
    • B. Wen, L. Ma, D. Rodrigues, M. Zhu. Detection of novel reactive metabolites of trazodone: evidence for CYP2D6-mediated bioactivation of m-chlorophenylpiperazine. Drug Metabolism and Disposition 2008, 36, 841.
    • (2008) Drug Metabolism and Disposition , vol.36 , pp. 841
    • Wen, B.1    Ma, L.2    Rodrigues, D.3    Zhu, M.4
  • 20
    • 34250190975 scopus 로고    scopus 로고
    • Use of a trapping agent for simultaneous capturing and high-throughput screening of both "soft" and "hard" reactive metabolites
    • Z. Yan, N. Maher, R. Torres, N. Huebert. Use of a trapping agent for simultaneous capturing and high-throughput screening of both "soft" and "hard" reactive metabolites. Analytical Chemistry 2007, 79, 4206.
    • (2007) Analytical Chemistry , vol.79 , pp. 4206
    • Yan, Z.1    Maher, N.2    Torres, R.3    Huebert, N.4
  • 21
    • 27144477300 scopus 로고    scopus 로고
    • Cyanide trapping of iminium ion reactive intermediates followed by detection and structure identification using liquid chromatography-tandem mass spectrometry LC-MS/MS
    • D. Argoti, L. Liang, A. Conteh, L. Chen, D. Bershas, C. P. Yu, P. Vouros, E. Yang. Cyanide trapping of iminium ion reactive intermediates followed by detection and structure identification using liquid chromatography-tandem mass spectrometry LC-MS/MS. Chemical Research in Toxicology 2005, 18, 1537.
    • (2005) Chemical Research in Toxicology , vol.18 , pp. 1537
    • Argoti, D.1    Liang, L.2    Conteh, A.3    Chen, L.4    Bershas, D.5    Yu, C.P.6    Vouros, P.7    Yang, E.8
  • 23
    • 66149192288 scopus 로고    scopus 로고
    • Rapid screening and characterization of drug metabolites using multiple ion monitoring dependent product ion scan and post acquisition data mining on a hybrid triple quadrupole-linear ion trap mass spectrometer
    • M. Yao, L. Ma, E. Duchoslav, M. Zhu. Rapid screening and characterization of drug metabolites using multiple ion monitoring dependent product ion scan and post acquisition data mining on a hybrid triple quadrupole-linear ion trap mass spectrometer. Rapid Communications in Mass Spectrometry 2009, 23, 1683.
    • (2009) Rapid Communications in Mass Spectrometry , vol.23 , pp. 1683
    • Yao, M.1    Ma, L.2    Duchoslav, E.3    Zhu, M.4
  • 24
    • 27844579198 scopus 로고    scopus 로고
    • Rapid detection and identification of N-acetyl-L-cysteine thioethers using constant neutral loss and theoretical multiple reaction monitoring combined with enhanced product-ion scans on a linear ion trap mass spectrometer
    • K. Scholz, W. Dekant, W. Volkel, A. Pahler. Rapid detection and identification of N-acetyl-L-cysteine thioethers using constant neutral loss and theoretical multiple reaction monitoring combined with enhanced product-ion scans on a linear ion trap mass spectrometer. Journal of the American Society for Mass Spectrometry 2005, 16, 1976.
    • (2005) Journal of the American Society for Mass Spectrometry , vol.16 , pp. 1976
    • Scholz, K.1    Dekant, W.2    Volkel, W.3    Pahler, A.4
  • 25
    • 33144456906 scopus 로고    scopus 로고
    • Metabonomics and biomarker discovery: LC-MS metabolic profiling and constant neutral loss scanning combined with multivariate data analysis formercapturic acid analysis
    • S. Wagner, K. Scholz, M. Donegan, L. Burton, J. Wingate, W. Volkel. Metabonomics and biomarker discovery: LC-MS metabolic profiling and constant neutral loss scanning combined with multivariate data analysis formercapturic acid analysis. Analytical Chemistry 2006, 78, 1296.
    • (2006) Analytical Chemistry , vol.78 , pp. 1296
    • Wagner, S.1    Scholz, K.2    Donegan, M.3    Burton, L.4    Wingate, J.5    Volkel, W.6
  • 26
    • 34247115128 scopus 로고    scopus 로고
    • Tools in metabonomics: An integrated validation approach for LC-MS metabolic profiling of mercapturic acids in human urine
    • S. Wagner, K. Scholz, M. Sieber, M. Kellert, W. Voelkel. Tools in metabonomics: an integrated validation approach for LC-MS metabolic profiling of mercapturic acids in human urine. Analytical Chemistry 2007, 79, 2918.
    • (2007) Analytical Chemistry , vol.79 , pp. 2918
    • Wagner, S.1    Scholz, K.2    Sieber, M.3    Kellert, M.4    Voelkel, W.5
  • 27
    • 34250753332 scopus 로고    scopus 로고
    • Screening and identification of GSH-trapped reactive metabolites using hybrid triple quadruple linear ion trap mass spectrometry
    • J. Zheng, L. Ma, B. Xin, T. Olah, W. G. Humphreys, M. Zhu. Screening and identification of GSH-trapped reactive metabolites using hybrid triple quadruple linear ion trap mass spectrometry. Chemical Research in Toxicology 2007, 20, 757.
    • (2007) Chemical Research in Toxicology , vol.20 , pp. 757
    • Zheng, J.1    Ma, L.2    Xin, B.3    Olah, T.4    Humphreys, W.G.5    Zhu, M.6
  • 28
    • 36248956546 scopus 로고    scopus 로고
    • Method for rapid metabolite profiling of drug candidates in fresh hepatocytes using liquid chromatography coupled with a hybrid quadrupole linear ion trap
    • H. Gao, O. L. Materne, D. L. Howe, C. L. Brummel. Method for rapid metabolite profiling of drug candidates in fresh hepatocytes using liquid chromatography coupled with a hybrid quadrupole linear ion trap. Rapid Communications in Mass Spectrometry 2007, 21, 3683.
    • (2007) Rapid Communications in Mass Spectrometry , vol.21 , pp. 3683
    • Gao, H.1    Materne, O.L.2    Howe, D.L.3    Brummel, C.L.4
  • 29
    • 33344464424 scopus 로고    scopus 로고
    • Application of a linear ion trap/orbitrap mass spectrometer in metabolite characterization studies: Examination of the human liver microsomal metabolism of the non-tricyclic anti-depressant nefazodone using data-dependent accurate mass measurements
    • S. M. Peterman, N. Duczak Jr., A. S. Kalgutkar, M. E. Lame, J. R. Soglia. Application of a linear ion trap/orbitrap mass spectrometer in metabolite characterization studies: examination of the human liver microsomal metabolism of the non-tricyclic anti-depressant nefazodone using data-dependent accurate mass measurements. Journal of the American Society for Mass Spectrometry 2006, 17, 363.
    • (2006) Journal of the American Society for Mass Spectrometry , vol.17 , pp. 363
    • Peterman, S.M.1    Duczak Jr., N.2    Kalgutkar, A.S.3    Lame, M.E.4    Soglia, J.R.5
  • 31
    • 10044279528 scopus 로고    scopus 로고
    • Stable-isotope trapping and high-throughput screenings of reactive metabolites using the isotope MS signature
    • Z. Yan, G. W. Caldwell. Stable-isotope trapping and high-throughput screenings of reactive metabolites using the isotope MS signature. Analytical Chemistry 2004, 76, 6835.
    • (2004) Analytical Chemistry , vol.76 , pp. 6835
    • Yan, Z.1    Caldwell, G.W.2
  • 32
    • 12344263826 scopus 로고    scopus 로고
    • Strategies for characterization of drug metabolites using liquid chromatography-tandem mass spectrometry in conjunction with chemical derivatization and on-line H/D exchange approaches
    • D. Q. Liu, C. E. Hop. Strategies for characterization of drug metabolites using liquid chromatography-tandem mass spectrometry in conjunction with chemical derivatization and on-line H/D exchange approaches. Journal of Pharmaceutical and Biomedical Analysis 2005, 37, 1.
    • (2005) Journal of Pharmaceutical and Biomedical Analysis , vol.37 , pp. 1
    • Liu, D.Q.1    Hop, C.E.2
  • 34
    • 41149180635 scopus 로고    scopus 로고
    • High-throughput screening and characterization of reactive metabolites using polarity switching of hybrid triple quadrupole linear ion trap mass spectrometry
    • B. Wen, L. Ma, S. D. Nelson, M. Zhu. High-throughput screening and characterization of reactive metabolites using polarity switching of hybrid triple quadrupole linear ion trap mass spectrometry. Analytical Chemistry 2008, 80, 1788.
    • (2008) Analytical Chemistry , vol.80 , pp. 1788
    • Wen, B.1    Ma, L.2    Nelson, S.D.3    Zhu, M.4
  • 35
    • 58249118866 scopus 로고    scopus 로고
    • Screening and characterization of reactive metabolites using glutathione ethyl ester in combination with Q-trap mass spectrometry
    • B. Wen, W. L. Fitch. Screening and characterization of reactive metabolites using glutathione ethyl ester in combination with Q-trap mass spectrometry. Journal of Mass Spectrometry 2009, 44, 90.
    • (2009) Journal of Mass Spectrometry , vol.44 , pp. 90
    • Wen, B.1    Fitch, W.L.2
  • 36
    • 41949120073 scopus 로고    scopus 로고
    • Bioactivation of the tricyclic antidepressant amitriptyline and its metabolite nortriptyline to arene oxide intermediates in human liver microsomes and recombinant P450s
    • B. Wen, L. Ma, M. Zhu. Bioactivation of the tricyclic antidepressant amitriptyline and its metabolite nortriptyline to arene oxide intermediates in human liver microsomes and recombinant P450s. Chemico-Biological Interactions 2008, 173, 59.
    • (2008) Chemico-Biological Interactions , vol.173 , pp. 59
    • Wen, B.1    Ma, L.2    Zhu, M.3
  • 37
    • 50049128215 scopus 로고    scopus 로고
    • Unbiased high-throughput screening of reactive metabolites on the linear ion trap mass spectrometer using polarity switch and mass tag triggered data-dependent acquisition
    • Z. Yan, G. W. Caldwell, N. Maher. Unbiased high-throughput screening of reactive metabolites on the linear ion trap mass spectrometer using polarity switch and mass tag triggered data-dependent acquisition. Analytical Chemistry 2008, 80, 6410.
    • (2008) Analytical Chemistry , vol.80 , pp. 6410
    • Yan, Z.1    Caldwell, G.W.2    Maher, N.3
  • 38
    • 34247542644 scopus 로고    scopus 로고
    • N-in-one' strategy for metabolite identification using a liquid chromatography/hybrid triple quadrupole linear ion trap instrument using multiple dependent product ion scans triggered with full mass scan
    • A. C. Li, M. A. Gohdes, W. Z. Shou. 'N-in-one' strategy for metabolite identification using a liquid chromatography/hybrid triple quadrupole linear ion trap instrument using multiple dependent product ion scans triggered with full mass scan. Rapid Communications in Mass Spectrometry 2007, 21, 1421.
    • (2007) Rapid Communications in Mass Spectrometry , vol.21 , pp. 1421
    • Li, A.C.1    Gohdes, M.A.2    Shou, W.Z.3
  • 39
    • 39749201504 scopus 로고    scopus 로고
    • An integrated method for metabolite detection and identification using a linear ion trap/Orbitrap mass spectrometer and multiple data processing techniques: Application to indinavir metabolite detection
    • Q. Ruan, S. Peterman, M. A. Szewc, L. Ma, D. Cui, W. G. Humphreys, M. Zhu. An integrated method for metabolite detection and identification using a linear ion trap/Orbitrap mass spectrometer and multiple data processing techniques: application to indinavir metabolite detection. Journal of Mass Spectrometry 2008, 43, 251.
    • (2008) Journal of Mass Spectrometry , vol.43 , pp. 251
    • Ruan, Q.1    Peterman, S.2    Szewc, M.A.3    Ma, L.4    Cui, D.5    Humphreys, W.G.6    Zhu, M.7
  • 40
    • 25144468977 scopus 로고    scopus 로고
    • All-in-one' analysis for metabolite identification using liquid chromatography/hybrid quadrupole time-of-flight mass spectrometry with collision energy switching
    • M. Wrona, T. Mauriala, K. P. Bateman, R. J. Mortishire-Smith, D. O'Connor. 'All-in-one' analysis for metabolite identification using liquid chromatography/hybrid quadrupole time-of-flight mass spectrometry with collision energy switching. Rapid Communications in Mass Spectrometry 2005, 19, 2597.
    • (2005) Rapid Communications in Mass Spectrometry , vol.19 , pp. 2597
    • Wrona, M.1    Mauriala, T.2    Bateman, K.P.3    Mortishire-Smith, R.J.4    O'Connor, D.5
  • 41
    • 41549139685 scopus 로고    scopus 로고
    • High-throughput, accurate mass liquid chromatography/tandem mass spectrometry on a quadrupole time-of-flight system as a 'first-line' approach for metabolite identification studies
    • P. R. Tiller, S. Yu, J. Castro-Perez, K. L. Fillgrove, T. A. Baillie. High-throughput, accurate mass liquid chromatography/tandem mass spectrometry on a quadrupole time-of-flight system as a 'first-line' approach for metabolite identification studies. Rapid Communications in Mass Spectrometry 2008, 22, 1053.
    • (2008) Rapid Communications in Mass Spectrometry , vol.22 , pp. 1053
    • Tiller, P.R.1    Yu, S.2    Castro-Perez, J.3    Fillgrove, K.L.4    Baillie, T.A.5
  • 42
    • 33847212842 scopus 로고    scopus 로고
    • Current and future trends in the application of HPLC-MS tometabolite-identification studies
    • J. M. Castro-Perez. Current and future trends in the application of HPLC-MS tometabolite-identification studies. Drug Discovery Today 2007, 12, 249.
    • (2007) Drug Discovery Today , vol.12 , pp. 249
    • Castro-Perez, J.M.1
  • 44
    • 0035983392 scopus 로고    scopus 로고
    • Use of a liquid chromatography/ion trap mass spectrometry/triple quadrupole mass spectrometry system for metabolite identification
    • D. Q. Liu, Y. Q. Xia, R. Bakhtiar. Use of a liquid chromatography/ion trap mass spectrometry/triple quadrupole mass spectrometry system for metabolite identification. Rapid Communications in Mass Spectrometry 2002, 16, 1330.
    • (2002) Rapid Communications in Mass Spectrometry , vol.16 , pp. 1330
    • Liu, D.Q.1    Xia, Y.Q.2    Bakhtiar, R.3
  • 45
    • 0242521617 scopus 로고    scopus 로고
    • A software filter to remove interference ions from drug metabolites in accurate mass liquid chromatography/mass spectrometric analyses
    • H. Zhang, D. Zhang, K. Ray. A software filter to remove interference ions from drug metabolites in accurate mass liquid chromatography/mass spectrometric analyses. Journal of Mass Spectrometry 2003, 38, 1110.
    • (2003) Journal of Mass Spectrometry , vol.38 , pp. 1110
    • Zhang, H.1    Zhang, D.2    Ray, K.3
  • 46
    • 33644839473 scopus 로고    scopus 로고
    • Accurate mass measurement for the determination of elemental formula - a tutorial
    • A. W. Bristow. Accurate mass measurement for the determination of elemental formula - a tutorial. Mass Spectrometry Reviews 2006, 25, 99.
    • (2006) Mass Spectrometry Reviews , vol.25 , pp. 99
    • Bristow, A.W.1
  • 47
    • 57249091714 scopus 로고    scopus 로고
    • Orbitrap mass spectrometry: Instrumentation, ion motion and applications
    • R. H. Perry, R. G. Cooks, R. J. Noll. Orbitrap mass spectrometry: instrumentation, ion motion and applications. Mass Spectrometry Reviews 2008, 27, 661.
    • (2008) Mass Spectrometry Reviews , vol.27 , pp. 661
    • Perry, R.H.1    Cooks, R.G.2    Noll, R.J.3
  • 48
    • 0034652244 scopus 로고    scopus 로고
    • Quantification and rapid metabolite identification in drug discovery using API time-of-flight LC/MS
    • N. Zhang, S. T. Fountain, H. Bi, D. T. Rossi. Quantification and rapid metabolite identification in drug discovery using API time-of-flight LC/MS. Analytical Chemistry 2000, 72, 800.
    • (2000) Analytical Chemistry , vol.72 , pp. 800
    • Zhang, N.1    Fountain, S.T.2    Bi, H.3    Rossi, D.T.4
  • 49
    • 34250707998 scopus 로고    scopus 로고
    • Metabolite identification by data-dependent accurate mass spectrometric analysis at resolving power of 60,000 in external calibration mode using an LTQ/Orbitrap
    • H. K. Lim, J. Chen, C. Sensenhauser, K. Cook, V. Subrahmanyam. Metabolite identification by data-dependent accurate mass spectrometric analysis at resolving power of 60,000 in external calibration mode using an LTQ/Orbitrap. Rapid Communications in Mass Spectrometry 2007, 21, 1821.
    • (2007) Rapid Communications in Mass Spectrometry , vol.21 , pp. 1821
    • Lim, H.K.1    Chen, J.2    Sensenhauser, C.3    Cook, K.4    Subrahmanyam, V.5
  • 50
    • 56149091565 scopus 로고    scopus 로고
    • Rapid metabolite identification with sub parts-per-million mass accuracy from biological matrices by direct infusion nanoelectrospray ionization after clean-up on a ZipTip and LTQ/Orbitrap mass spectrometry
    • J. C. Erve, W. Demaio, R. E. Talaat. Rapid metabolite identification with sub parts-per-million mass accuracy from biological matrices by direct infusion nanoelectrospray ionization after clean-up on a ZipTip and LTQ/Orbitrap mass spectrometry. Rapid Communications in Mass Spectrometry 2008, 22, 3015.
    • (2008) Rapid Communications in Mass Spectrometry , vol.22 , pp. 3015
    • Erve, J.C.1    Demaio, W.2    Talaat, R.E.3
  • 51
    • 47749089748 scopus 로고    scopus 로고
    • Introduction of HPLC/orbitrap mass spectrometry as screening method for doping control
    • E. D. Virus, T. G. Sobolevsky, G. M. Rodchenkov. Introduction of HPLC/orbitrap mass spectrometry as screening method for doping control. Journal of Mass Spectrometry 2008, 43, 949.
    • (2008) Journal of Mass Spectrometry , vol.43 , pp. 949
    • Virus, E.D.1    Sobolevsky, T.G.2    Rodchenkov, G.M.3
  • 52
    • 33748902567 scopus 로고    scopus 로고
    • Detection and characterization of metabolites in biological matrices using mass defect filtering of liquid chromatography/high resolution mass spectrometry data
    • M. Zhu, L. Ma, D. Zhang, K. Ray, W. Zhao, W. G. Humphreys, G. Skiles, M. Sanders, H. Zhang. Detection and characterization of metabolites in biological matrices using mass defect filtering of liquid chromatography/high resolution mass spectrometry data. Drug Metabolism and Disposition 2006, 34, 1722.
    • (2006) Drug Metabolism and Disposition , vol.34 , pp. 1722
    • Zhu, M.1    Ma, L.2    Zhang, D.3    Ray, K.4    Zhao, W.5    Humphreys, W.G.6    Skiles, G.7    Sanders, M.8    Zhang, H.9
  • 53
    • 25144438177 scopus 로고    scopus 로고
    • Accelerated throughput metabolic route screening in early drug discovery using high-resolution liquid chromatography/quadrupole time-of-flight mass spectrometry and automated data analysis
    • R. J. Mortishire-Smith, D. O'Connor, J. M. Castro-Perez, J. Kirby. Accelerated throughput metabolic route screening in early drug discovery using high-resolution liquid chromatography/quadrupole time-of-flight mass spectrometry and automated data analysis. Rapid Communications in Mass Spectrometry 2005, 19, 2659.
    • (2005) Rapid Communications in Mass Spectrometry , vol.19 , pp. 2659
    • Mortishire-Smith, R.J.1    O'Connor, D.2    Castro-Perez, J.M.3    Kirby, J.4
  • 54
    • 35848937158 scopus 로고    scopus 로고
    • Detection and structural characterization of glutathione-trapped reactive metabolites using liquid chromatography-high-resolution mass spectrometry and mass defect filtering
    • M. Zhu, L. Ma, H. Zhang, W. G. Humphreys. Detection and structural characterization of glutathione-trapped reactive metabolites using liquid chromatography-high-resolution mass spectrometry and mass defect filtering. Analytical Chemistry 2007, 79, 8333.
    • (2007) Analytical Chemistry , vol.79 , pp. 8333
    • Zhu, M.1    Ma, L.2    Zhang, H.3    Humphreys, W.G.4
  • 55
    • 42649118458 scopus 로고    scopus 로고
    • A genericmethod to detect electrophilic intermediates using isotopic pattern triggered data-dependent high-resolution accurate mass spectrometry
    • H. K. Lim, J. Chen, K. Cook, C. Sensenhauser, J. Silva, D. C. Evans. A genericmethod to detect electrophilic intermediates using isotopic pattern triggered data-dependent high-resolution accurate mass spectrometry. Rapid Communications in Mass Spectrometry 2008, 22, 1295.
    • (2008) Rapid Communications in Mass Spectrometry , vol.22 , pp. 1295
    • Lim, H.K.1    Chen, J.2    Cook, K.3    Sensenhauser, C.4    Silva, J.5    Evans, D.C.6
  • 58
    • 46849098946 scopus 로고    scopus 로고
    • Mass defect filtering on high resolution LC/MS data as a methodology for detecting metabolites with unpredictable structures: Identification of oxazole-ring opened metabolites of muraglitazar
    • D. Zhang, P. T. Cheng, H. Zhang. Mass defect filtering on high resolution LC/MS data as a methodology for detecting metabolites with unpredictable structures: identification of oxazole-ring opened metabolites of muraglitazar. Drug Metabolism Letters 2007, 1, 287.
    • (2007) Drug Metabolism Letters , vol.1 , pp. 287
    • Zhang, D.1    Cheng, P.T.2    Zhang, H.3
  • 61
    • 67650437134 scopus 로고    scopus 로고
    • Metabolite identification using multiple mass defect filters and higher energy collisional dissociation on a hybrid mass spectrometer
    • Y. Huang, S. Lui, S. Miao, P. M. Jeanville. Metabolite identification using multiple mass defect filters and higher energy collisional dissociation on a hybrid mass spectrometer. Current Trends in Mass Spectrometry 2008, 24.
    • (2008) Current Trends in Mass Spectrometry , pp. 24
    • Huang, Y.1    Lui, S.2    Miao, S.3    Jeanville, P.M.4
  • 66
    • 0035472251 scopus 로고    scopus 로고
    • Kendrick mass defect spectrum: A compact visual analysis for ultrahigh-resolution broadband mass spectra
    • C. A. Hughey, C. L. Hendrickson, R. P. Rodgers, A. G. Marshall, K. Qian. Kendrick mass defect spectrum: a compact visual analysis for ultrahigh-resolution broadband mass spectra. Analytical Chemistry 2001, 73, 4676.
    • (2001) Analytical Chemistry , vol.73 , pp. 4676
    • Hughey, C.A.1    Hendrickson, C.L.2    Rodgers, R.P.3    Marshall, A.G.4    Qian, K.5
  • 67
    • 62249135160 scopus 로고    scopus 로고
    • Approaches to the assessment of stable and chemically reactive drug metabolites in early clinical trials
    • T. A. Baillie. Approaches to the assessment of stable and chemically reactive drug metabolites in early clinical trials. Chemical Research in Toxicology 2009, 22, 263.
    • (2009) Chemical Research in Toxicology , vol.22 , pp. 263
    • Baillie, T.A.1
  • 68
    • 62249142787 scopus 로고    scopus 로고
    • Which human metabolites have we MIST? Retrospective analysis, practical aspects, and perspectives for metabolite identification and quantification in pharmaceutical development
    • L. Leclercq, F. Cuyckens, G. S. Mannens, R. de Vries, P. Timmerman, D. C. Evans. Which human metabolites have we MIST? Retrospective analysis, practical aspects, and perspectives for metabolite identification and quantification in pharmaceutical development. Chemical Research in Toxicology 2009, 22, 280.
    • (2009) Chemical Research in Toxicology , vol.22 , pp. 280
    • Leclercq, L.1    Cuyckens, F.2    Mannens, G.S.3    de Vries, R.4    Timmerman, P.5    Evans, D.C.6
  • 69
    • 46849091191 scopus 로고    scopus 로고
    • Mass defect profiles of biological matrices and the general applicability of mass defect filtering for metabolite detection
    • H. Zhang, M. Zhu, K. L. Ray, L. Ma, D. Zhang. Mass defect profiles of biological matrices and the general applicability of mass defect filtering for metabolite detection. Rapid Communications in Mass Spectrometry 2008, 22, 2082.
    • (2008) Rapid Communications in Mass Spectrometry , vol.22 , pp. 2082
    • Zhang, H.1    Zhu, M.2    Ray, K.L.3    Ma, L.4    Zhang, D.5
  • 72
    • 52649120186 scopus 로고    scopus 로고
    • An algorithm for thorough background subtraction from high-resolution LC/MS data: Application to the detection of troglitazone metabolites in rat plasma, bile, and urine
    • H. Zhang, L. Ma, K. He, M. Zhu. An algorithm for thorough background subtraction from high-resolution LC/MS data: application to the detection of troglitazone metabolites in rat plasma, bile, and urine. Journal of Mass Spectrometry 2008, 43, 1191.
    • (2008) Journal of Mass Spectrometry , vol.43 , pp. 1191
    • Zhang, H.1    Ma, L.2    He, K.3    Zhu, M.4
  • 74
    • 52649157604 scopus 로고    scopus 로고
    • An algorithm for thorough background subtraction from high-resolution LC/MS data: Application for detection of glutathione-trapped reactive metabolites
    • H. Zhang, Y. Yang. An algorithm for thorough background subtraction from high-resolution LC/MS data: application for detection of glutathione-trapped reactive metabolites. Journal of Mass Spectrometry 2008, 43, 1181.
    • (2008) Journal of Mass Spectrometry , vol.43 , pp. 1181
    • Zhang, H.1    Yang, Y.2
  • 76
    • 66149168573 scopus 로고    scopus 로고
    • A retention-time-shift-tolerant background subtraction and noise reduction algorithm BgS-NoRA for extraction of drug metabolites in liquid chromatography/mass spectrometry data from biological matrices
    • P. Zhu, W. Ding, W. Tong, A. Ghosal, K. Alton, S. Chowdhury. A retention-time-shift-tolerant background subtraction and noise reduction algorithm BgS-NoRA for extraction of drug metabolites in liquid chromatography/mass spectrometry data from biological matrices. Rapid Communications in Mass Spectrometry 2009, 23, 1563.
    • (2009) Rapid Communications in Mass Spectrometry , vol.23 , pp. 1563
    • Zhu, P.1    Ding, W.2    Tong, W.3    Ghosal, A.4    Alton, K.5    Chowdhury, S.6
  • 77
    • 64849083012 scopus 로고    scopus 로고
    • Algorithm for thorough background subtraction of high-resolution LC/MS data: Application to obtain clean product ion spectra from nonselective collision-induced dissociation experiments
    • H. Zhang, M. Grubb, W. Wu, J. Josephs, W. G. Humphreys. Algorithm for thorough background subtraction of high-resolution LC/MS data: application to obtain clean product ion spectra from nonselective collision-induced dissociation experiments. Analytical Chemistry 2009, 81, 2695.
    • (2009) Analytical Chemistry , vol.81 , pp. 2695
    • Zhang, H.1    Grubb, M.2    Wu, W.3    Josephs, J.4    Humphreys, W.G.5
  • 79
    • 63449101078 scopus 로고    scopus 로고
    • Quantitation of small molecules using high-resolution accurate mass spectrometers - a different approach for analysis of biological samples
    • N. R. Zhang, S. Yu, P. Tiller, S. Yeh, E. Mahan, W. B. Emary. Quantitation of small molecules using high-resolution accurate mass spectrometers - a different approach for analysis of biological samples. Rapid Communications in Mass Spectrometry 2009, 23, 1085.
    • (2009) Rapid Communications in Mass Spectrometry , vol.23 , pp. 1085
    • Zhang, N.R.1    Yu, S.2    Tiller, P.3    Yeh, S.4    Mahan, E.5    Emary, W.B.6


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