3-(2-Ethyl-5-oxohexyl)phthalic acid (BioDeep_00000181516)
human metabolite blood metabolite
代谢物信息卡片
3-(2-ethyl-5-oxohexyl)benzene-1,2-dicarboxylic acid
化学式: C16H20O5 (292.13106700000003)
中文名称:
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CCC(CCC(=O)C)CC1=C(C(=CC=C1)C(=O)O)C(=O)O
InChI: InChI=1S/C16H20O5/c1-3-11(8-7-10(2)17)9-12-5-4-6-13(15(18)19)14(12)16(20)21/h4-6,11H,3,7-9H2,1-2H3,(H,18,19)(H,20,21)
相关代谢途径
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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。
文献列表
- Núria Monfort, Rosa Ventura, Georgina Balcells, Jordi Segura. Determination of five di-(2-ethylhexyl)phthalate metabolites in urine by UPLC-MS/MS, markers of blood transfusion misuse in sports.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2012 Nov; 908(?):113-21. doi:
10.1016/j.jchromb.2012.09.030. [PMID: 23040990] - Núria Monfort, Rosa Ventura, Petra Platen, Timo Hinrichs, Klara Brixius, Wilhelm Schänzer, Mario Thevis, Hans Geyer, Jordi Segura. Plasticizers excreted in urine: indication of autologous blood transfusion in sports.
Transfusion.
2012 Mar; 52(3):647-57. doi:
10.1111/j.1537-2995.2011.03331.x. [PMID: 21895677] - Michelle Romero-Franco, Raúl U Hernández-Ramírez, Antonia M Calafat, Mariano E Cebrián, Larry L Needham, Susan Teitelbaum, Mary S Wolff, Lizbeth López-Carrillo. Personal care product use and urinary levels of phthalate metabolites in Mexican women.
Environment international.
2011 Jul; 37(5):867-71. doi:
10.1016/j.envint.2011.02.014. [PMID: 21429583] - Moon-seo Park, Yun-jung Yang, Yeon-pyo Hong, Sang-yon Kim, Yong-pil Lee. Assessment of di (2-ethylhexyl) phthalate exposure by urinary metabolites as a function of sampling time.
Journal of preventive medicine and public health = Yebang Uihakhoe chi.
2010 Jul; 43(4):301-8. doi:
10.3961/jpmph.2010.43.4.301. [PMID: 20689356] - Soo-Churl Cho, Soo-Young Bhang, Yun-Chul Hong, Min-Sup Shin, Boong-Nyun Kim, Jae-Won Kim, Hee-Jung Yoo, In Hee Cho, Hyo-Won Kim. Relationship between environmental phthalate exposure and the intelligence of school-age children.
Environmental health perspectives.
2010 Jul; 118(7):1027-32. doi:
10.1289/ehp.0901376. [PMID: 20194078] - S H Swan, F Liu, M Hines, R L Kruse, C Wang, J B Redmon, A Sparks, B Weiss. Prenatal phthalate exposure and reduced masculine play in boys.
International journal of andrology.
2010 Apr; 33(2):259-69. doi:
10.1111/j.1365-2605.2009.01019.x. [PMID: 19919614] - Núria Monfort, Rosa Ventura, Ana Latorre, Viviana Belalcazar, Mercè López, Jordi Segura. Urinary di-(2-ethylhexyl)phthalate metabolites in athletes as screening measure for illicit blood doping: a comparison study with patients receiving blood transfusion.
Transfusion.
2010 Jan; 50(1):145-9. doi:
10.1111/j.1537-2995.2009.02352.x. [PMID: 19694994] - Caroline Herr, Anja zur Nieden, Holger M Koch, Hans-Christian Schuppe, Christian Fieber, Jürgen Angerer, Thomas Eikmann, Nikolaos I Stilianakis. Urinary di(2-ethylhexyl)phthalate (DEHP)--metabolites and male human markers of reproductive function.
International journal of hygiene and environmental health.
2009 Nov; 212(6):648-53. doi:
10.1016/j.ijheh.2009.08.001. [PMID: 19733116] - Sibylle Hildenbrand, Roman Wodarz, Thomas Gabrio, Gerhard Volland. Biomonitoring of the di(2-ethylhexyl) phthalate metabolites mono(2-ethyl-5-hydroxyhexyl) phthalate and mono(2-ethyl-5-oxohexyl) phthalate in children and adults during the course of time and seasons.
International journal of hygiene and environmental health.
2009 Nov; 212(6):679-84. doi:
10.1016/j.ijheh.2009.06.003. [PMID: 19615938] - Mary S Wolff, Stephanie M Engel, Gertrud S Berkowitz, Xiaoyun Ye, Manori J Silva, Chenbo Zhu, James Wetmur, Antonia M Calafat. Prenatal phenol and phthalate exposures and birth outcomes.
Environmental health perspectives.
2008 Aug; 116(8):1092-7. doi:
10.1289/ehp.11007. [PMID: 18709157] - R Hauser, J D Meeker, N P Singh, M J Silva, L Ryan, S Duty, A M Calafat. DNA damage in human sperm is related to urinary levels of phthalate monoester and oxidative metabolites.
Human reproduction (Oxford, England).
2007 Mar; 22(3):688-95. doi:
10.1093/humrep/del428. [PMID: 17090632] - Matthias Wittassek, Wolfgang Heger, Holger M Koch, Kerstin Becker, Jürgen Angerer, Marike Kolossa-Gehring. Daily intake of di(2-ethylhexyl)phthalate (DEHP) by German children -- A comparison of two estimation models based on urinary DEHP metabolite levels.
International journal of hygiene and environmental health.
2007 Jan; 210(1):35-42. doi:
10.1016/j.ijheh.2006.11.009. [PMID: 17185035] - Jennifer Weuve, Brisa N Sánchez, Antonia M Calafat, Ted Schettler, Ronald A Green, Howard Hu, Russ Hauser. Exposure to phthalates in neonatal intensive care unit infants: urinary concentrations of monoesters and oxidative metabolites.
Environmental health perspectives.
2006 Sep; 114(9):1424-31. doi:
10.1289/ehp.8926. [PMID: 16966100] - Kayumi Fujimaki, Jun Yoshinaga, Chiho Watanabe, Shigeko Serizawa, Hiroaki Shiraishi, Yoshifumi Mizumoto. [Estimation of intake level of di (2-ethyhexyl) phthalate (DEHP) in Japanese pregnant women based on measurement of concentrations of three urinary metabolites].
Nihon eiseigaku zasshi. Japanese journal of hygiene.
2006 May; 61(3):340-7. doi:
10.1265/jjh.61.340. [PMID: 16768165] - H M Koch, R Preuss, J Angerer. Di(2-ethylhexyl)phthalate (DEHP): human metabolism and internal exposure-- an update and latest results.
International journal of andrology.
2006 Feb; 29(1):155-65; discussion 181. doi:
10.1111/j.1365-2605.2005.00607.x. [PMID: 16466535] - Holger M Koch, Hermann M Bolt, Ralf Preuss, Jürgen Angerer. New metabolites of di(2-ethylhexyl)phthalate (DEHP) in human urine and serum after single oral doses of deuterium-labelled DEHP.
Archives of toxicology.
2005 Jul; 79(7):367-76. doi:
10.1007/s00204-004-0642-4. [PMID: 15700144] - Ralf Preuss, Holger M Koch, Jürgen Angerer. Biological monitoring of the five major metabolites of di-(2-ethylhexyl)phthalate (DEHP) in human urine using column-switching liquid chromatography-tandem mass spectrometry.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2005 Feb; 816(1-2):269-80. doi:
10.1016/j.jchromb.2004.11.048. [PMID: 15664359] - Holger M Koch, Jürgen Angerer, Hans Drexler, Reinhold Eckstein, Volker Weisbach. Di(2-ethylhexyl)phthalate (DEHP) exposure of voluntary plasma and platelet donors.
International journal of hygiene and environmental health.
2005; 208(6):489-98. doi:
10.1016/j.ijheh.2005.07.001. [PMID: 16325559] - Holger M Koch, Hermann M Bolt, Jürgen Angerer. Di(2-ethylhexyl)phthalate (DEHP) metabolites in human urine and serum after a single oral dose of deuterium-labelled DEHP.
Archives of toxicology.
2004 Mar; 78(3):123-30. doi:
10.1007/s00204-003-0522-3. [PMID: 14576974] - Kayoko Kato, Manori J Silva, John A Reidy, Donald Hurtz, Nicole A Malek, Larry L Needham, Hiroyuki Nakazawa, Dana B Barr, Antonia M Calafat. Mono(2-ethyl-5-hydroxyhexyl) phthalate and mono-(2-ethyl-5-oxohexyl) phthalate as biomarkers for human exposure assessment to di-(2-ethylhexyl) phthalate.
Environmental health perspectives.
2004 Mar; 112(3):327-30. doi:
10.1289/ehp.6663. [PMID: 14998748] - Holger M Koch, Hans Drexler, Jürgen Angerer. Internal exposure of nursery-school children and their parents and teachers to di(2-ethylhexyl)phthalate (DEHP).
International journal of hygiene and environmental health.
2004 Jan; 207(1):15-22. doi:
10.1078/1438-4639-00270. [PMID: 14762970] - Holger M Koch, Bernd Rossbach, Hans Drexler, Jürgen Angerer. Internal exposure of the general population to DEHP and other phthalates--determination of secondary and primary phthalate monoester metabolites in urine.
Environmental research.
2003 Oct; 93(2):177-85. doi:
10.1016/s0013-9351(03)00083-5. [PMID: 12963402] - Dana B Barr, Manori J Silva, Kayoko Kato, John A Reidy, Nicole A Malek, Donald Hurtz, Melissa Sadowski, Larry L Needham, Antonia M Calafat. Assessing human exposure to phthalates using monoesters and their oxidized metabolites as biomarkers.
Environmental health perspectives.
2003 Jul; 111(9):1148-51. doi:
10.1289/ehp.6074. [PMID: 12842765] - Manori J Silva, Nicole A Malek, Carolyn C Hodge, John A Reidy, Kayoko Kato, Dana B Barr, Larry L Needham, John W Brock. Improved quantitative detection of 11 urinary phthalate metabolites in humans using liquid chromatography-atmospheric pressure chemical ionization tandem mass spectrometry.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2003 Jun; 789(2):393-404. doi:
10.1016/s1570-0232(03)00164-8. [PMID: 12742130] - Holger M Koch, Hans Drexler, Jürgen Angerer. An estimation of the daily intake of di(2-ethylhexyl)phthalate (DEHP) and other phthalates in the general population.
International journal of hygiene and environmental health.
2003 Mar; 206(2):77-83. doi:
10.1078/1438-4639-00205. [PMID: 12708228]