1-(Difluoromethyl)-2,3,4-trifluorobenzene (BioDeep_00000172128)
human metabolite blood metabolite
代谢物信息卡片
1-(Difluoromethyl)-2,3,4-trifluorobenzene
化学式: C7H3F5 (182.0155)
中文名称:
谱图信息:
最多检出来源 Mus musculus(blood) 83.33%
分子结构信息
SMILES: C1=CC(=C(C(=C1C(F)F)F)F)F
InChI: InChI=1S/C7H3F5/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2,7H
数据库引用编号
分类词条
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
代谢反应
0 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(0)
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(0)
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
1 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：
- PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。
| 亚细胞结构定位 | 关联基因列表 |
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文献列表
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Alcoholism, clinical and experimental research.
2012 Jun; 36(6):1013-20. doi:
10.1111/j.1530-0277.2011.01705.x. [PMID: 22309940] - Arne Trettin, Alexander A Zoerner, Anke Böhmer, Frank-Mathias Gutzki, Dirk O Stichtenoth, Jens Jordan, Dimitrios Tsikas. Quantification of acetaminophen (paracetamol) in human plasma and urine by stable isotope-dilution GC-MS and GC-MS/MS as pentafluorobenzyl ether derivative.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2011 Aug; 879(23):2274-80. doi:
10.1016/j.jchromb.2011.06.012. [PMID: 21733763] - Wilmon F Grant, Melanie B Gillingham, Ayesha K Batra, Natasha M Fewkes, Sarah M Comstock, Diana Takahashi, Theodore P Braun, Kevin L Grove, Jacob E Friedman, Daniel L Marks. Maternal high fat diet is associated with decreased plasma n-3 fatty acids and fetal hepatic apoptosis in nonhuman primates.
PloS one.
2011 Feb; 6(2):e17261. doi:
10.1371/journal.pone.0017261. [PMID: 21364873] - Sharareh Eskandari, Jaleh Varshosaz, Mohsen Minaiyan, Majid Tabbakhian. Brain delivery of valproic acid via intranasal administration of nanostructured lipid carriers: in vivo pharmacodynamic studies using rat electroshock model.
International journal of nanomedicine.
2011; 6(?):363-71. doi:
10.2147/ijn.s15881. [PMID: 21499426] - Dimitrios Tsikas, Alexander Wolf, Anja Mitschke, Frank-Mathias Gutzki, Wolfgang Will, Michael Bader. GC-MS determination of creatinine in human biological fluids as pentafluorobenzyl derivative in clinical studies and biomonitoring: Inter-laboratory comparison in urine with Jaffé, HPLC and enzymatic assays.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2010 Oct; 878(27):2582-92. doi:
10.1016/j.jchromb.2010.04.025. [PMID: 20462809] - Dimitrios Tsikas, Kristine Chobanyan-Jürgens. Quantification of carbonate by gas chromatography-mass spectrometry.
Analytical chemistry.
2010 Oct; 82(19):7897-905. doi:
10.1021/ac1007688. [PMID: 20553048] - Chunhua Wu, Ping Liu, Lixing Zheng, Jia Chen, Zhijun Zhou. GC-FPD measurement of urinary dialkylphosphate metabolites of organophosphorous pesticides as pentafluorobenzyl derivatives in occupationally exposed workers and in a general population in Shanghai (China).
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2010 Oct; 878(27):2575-81. doi:
10.1016/j.jchromb.2010.07.021. [PMID: 20800556] - Trevor M Penning, Seon-Hwa Lee, Yi Jin, Alejandro Gutierrez, Ian A Blair. Liquid chromatography-mass spectrometry (LC-MS) of steroid hormone metabolites and its applications.
The Journal of steroid biochemistry and molecular biology.
2010 Aug; 121(3-5):546-55. doi:
10.1016/j.jsbmb.2010.01.005. [PMID: 20083198] - Emmie N M Ho, Terence S M Wan, April S Y Wong, Kenneth K H Lam, Peter J Schiff, Brian D Stewart. Control of the misuse of bromide in horses.
Drug testing and analysis.
2010 Jul; 2(7):323-9. doi:
10.1002/dta.141. [PMID: 20836143] - Dimitrios Tsikas, Alexandra Schwarz, Dirk O Stichtenoth. Simultaneous measurement of [15N]nitrate and [15N]nitrite enrichment and concentration in urine by gas chromatography mass spectrometry as pentafluorobenzyl derivatives.
Analytical chemistry.
2010 Mar; 82(6):2585-7. doi:
10.1021/ac902970m. [PMID: 20170083] - Venkatesan Radhika, Christian Kost, Wilhelm Boland, Martin Heil. The role of jasmonates in floral nectar secretion.
PloS one.
2010 Feb; 5(2):e9265. doi:
10.1371/journal.pone.0009265. [PMID: 20174464] - Helen D Donoghue, Oona Y-C Lee, David E Minnikin, Gurdyal S Besra, John H Taylor, Mark Spigelman. Tuberculosis in Dr Granville's mummy: a molecular re-examination of the earliest known Egyptian mummy to be scientifically examined and given a medical diagnosis.
Proceedings. Biological sciences.
2010 Jan; 277(1678):51-6. doi:
10.1098/rspb.2009.1484. [PMID: 19793751] - Dimitrios Tsikas, Alexander Zoerner, Anja Mitschke, Yahya Homsi, Frank-Mathias Gutzki, Jens Jordan. Specific GC-MS/MS stable-isotope dilution methodology for free 9- and 10-nitro-oleic acid in human plasma challenges previous LC-MS/MS reports.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2009 Sep; 877(26):2895-908. doi:
10.1016/j.jchromb.2008.12.062. [PMID: 19162569] - Viral V Brahmbhatt, Christopher Nold, Carolyn J Albert, David A Ford. Quantification of pentafluorobenzyl oxime derivatives of long chain aldehydes by GC-MS analysis.
Lipids.
2008 Mar; 43(3):275-80. doi:
10.1007/s11745-008-3153-x. [PMID: 18256866] - Gen-ichiro Arimura, Stefan Garms, Massimo Maffei, Simone Bossi, Birgit Schulze, Margit Leitner, Axel Mithöfer, Wilhelm Boland. Herbivore-induced terpenoid emission in Medicago truncatula: concerted action of jasmonate, ethylene and calcium signaling.
Planta.
2008 Jan; 227(2):453-64. doi:
10.1007/s00425-007-0631-y. [PMID: 17924138] - Israel Hershkovitz, Helen D Donoghue, David E Minnikin, Gurdyal S Besra, Oona Y-C Lee, Angela M Gernaey, Ehud Galili, Vered Eshed, Charles L Greenblatt, Eshetu Lemma, Gila Kahila Bar-Gal, Mark Spigelman. Detection and molecular characterization of 9,000-year-old Mycobacterium tuberculosis from a Neolithic settlement in the Eastern Mediterranean.
PloS one.
2008; 3(10):e3426. doi:
10.1371/journal.pone.0003426. [PMID: 18923677] - Jeongrim Lee, Bill X Huang, Zhixin Yuan, Hee-Yong Kim. Simultaneous determination of salsolinol enantiomers and dopamine in human plasma and cerebrospinal fluid by chemical derivatization coupled to chiral liquid chromatography/electrospray ionization-tandem mass spectrometry.
Analytical chemistry.
2007 Dec; 79(23):9166-73. doi:
10.1021/ac0715827. [PMID: 17973500] - Anja Mitschke, Frank-Mathias Gutzki, Dimitrios Tsikas. 9- and 10-Nitro-oleic acid do not interfere with the GC-MS quantitative determination of nitrite and nitrate in biological fluids when measured as their pentafluorobenzyl derivatives.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2007 May; 851(1-2):287-91. doi:
10.1016/j.jchromb.2007.02.032. [PMID: 17349828] - Peyton Jacob, Margaret Wilson, Neal L Benowitz. Determination of phenolic metabolites of polycyclic aromatic hydrocarbons in human urine as their pentafluorobenzyl ether derivatives using liquid chromatography-tandem mass spectrometry.
Analytical chemistry.
2007 Jan; 79(2):587-98. doi:
10.1021/ac060920l. [PMID: 17222024] - Yoshichika Kawai, Sayaka Takeda, Junji Terao. Lipidomic analysis for lipid peroxidation-derived aldehydes using gas chromatography-mass spectrometry.
Chemical research in toxicology.
2007 Jan; 20(1):99-107. doi:
10.1021/tx060199e. [PMID: 17226932] - Yiannis C Fiamegos, Constantine D Stalikas. Gas chromatographic determination of amino acids via one-step phase-transfer catalytic pentafluorobenzylation-preconcentration.
Journal of chromatography. A.
2006 Mar; 1110(1-2):66-72. doi:
10.1016/j.chroma.2006.01.074. [PMID: 16487532] - Adriaan A S Marais, Johannes B Laurens. Analysis of urinary biomarkers for exposure to alkyl benzenes by isotope dilution gas chromatography-mass spectrometry.
Journal of separation science.
2005 Dec; 28(18):2526-33. doi:
10.1002/jssc.200500205. [PMID: 16405184] - David C White, Roland Geyer, James Cantu, Sung-Chan Jo, Aaron D Peacock, Arnold M Saxton, Sachin Mani, Marti Jett, Owen R Moss. Feasibility of assessment of regulatory lipids in breath condensate as potential presymptomatic harbingers of pulmonary pathobiology.
Journal of microbiological methods.
2005 Sep; 62(3):293-302. doi:
10.1016/j.mimet.2005.04.013. [PMID: 15963585] - Chaza M Zghibeh, V Raj Gopal, Candace D Poff, J R Falck, Michael Balazy. Determination of trans-arachidonic acid isomers in human blood plasma.
Analytical biochemistry.
2004 Sep; 332(1):137-44. doi:
10.1016/j.ab.2004.04.030. [PMID: 15301958] - Michael L Selley. Increased (E)-4-hydroxy-2-nonenal and asymmetric dimethylarginine concentrations and decreased nitric oxide concentrations in the plasma of patients with major depression.
Journal of affective disorders.
2004 Jun; 80(2-3):249-56. doi:
10.1016/s0165-0327(03)00135-6. [PMID: 15207938] - Dimitrios Tsikas, Anja Mitschke, Frank-Mathias Gutzki, Hartmut H Meyer, Jürgen C Frölich. Gas chromatography-mass spectrometry of cis-9,10-epoxyoctadecanoic acid (cis-EODA). II. Quantitative determination of cis-EODA in human plasma.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2004 May; 804(2):403-12. doi:
10.1016/j.jchromb.2004.01.055. [PMID: 15081936] - Paolo Guidetti, Robert Schwarcz. Determination of alpha-aminoadipic acid in brain, peripheral tissues, and body fluids using GC/MS with negative chemical ionization.
Brain research. Molecular brain research.
2003 Oct; 118(1-2):132-9. doi:
10.1016/j.molbrainres.2003.08.004. [PMID: 14559362] - Minghong Jia, Wells W Wu, Richard A Yost, Paul A Chadik, Peter W Stacpoole, George N Henderson. Simultaneous determination of trace levels of nine haloacetic acids in biological samples as their pentafluorobenzyl derivatives by gas chromatography/tandem mass spectrometry in electron capture negative ion chemical ionization mode.
Analytical chemistry.
2003 Aug; 75(16):4065-80. doi:
10.1021/ac034036w. [PMID: 14632119] - Javier Sastre Toraño, Hendrikus J M van Kan. Simultaneous determination of the tobacco smoke uptake parameters nicotine, cotinine and thiocyanate in urine, saliva and hair, using gas chromatography-mass spectrometry for characterisation of smoking status of recently exposed subjects.
The Analyst.
2003 Jul; 128(7):838-43. doi:
10.1039/b304051h. [PMID: 12894819] - Dimitrios Tsikas, Masayuki Sawa, Gorig Brunner, Frank Mathias Gutzki, Hartmut H Meyer, Jürgen C Frölich. Gas chromatography-mass spectrometry of cis-9,10-epoxyoctadecanoic acid (cis-EODA). I. Direct evidence for cis-EODA formation from oleic acid oxidation by liver microsomes and isolated hepatocytes.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2003 Feb; 784(2):351-65. doi:
10.1016/s1570-0232(02)00821-8. [PMID: 12505783] - Thomas Wenzl, Ernst P Lankmayr, Reinhold Wintersteiger, Anton Sadjak, Rudolf Likar, Dieter Zakel. Determination and quantification of clonidine in human blood serum.
Journal of biochemical and biophysical methods.
2002 Oct; 53(1-3):131-9. doi:
10.1016/s0165-022x(02)00101-x. [PMID: 12406595] - Bernhard Watzer, Hannsjörg W Seyberth, Horst Schweer. Determination of misoprostol free acid in human breast milk and serum by gas chromatography/negative ion chemical ionization tandem mass spectrometry.
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2002 Sep; 37(9):927-33. doi:
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2002 Jul; 124(26):7745-54. doi:
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