Chloroprene (BioDeep_00000177405)

 

Secondary id: BioDeep_00000012686

human metabolite blood metabolite Volatile Flavor Compounds


代谢物信息卡片


2-chlorobuta-1,3-diene

化学式: C4H5Cl (88.00797600000001)
中文名称: 2-氯-1,3-丁二烯, 氯丁橡胶, 氯丁二烯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C=CC(=C)Cl
InChI: InChI=1S/C4H5Cl/c1-3-4(2)5/h3H,1-2H2

描述信息

同义名列表

9 个代谢物同义名

2-chlorobuta-1,3-diene; 2-Chloro-1,3-butadiene; 2-Chlor-1,3-butadien; 2-Chlorobutadiene; Polychloroprene; CHLOROPRENE; Polychloroprene; Chloroprene; Chloroprene



数据库引用编号

15 个数据库交叉引用编号

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。



文献列表

  • Tsuyoshi Kawakami, Maiko Tahara, Yoshiaki Ikarashi. Rosin-Related Compounds (Abietic Acid Derivatives) Concentrations in Chloroprene Rubber Products and the Amounts Eluted Into Artificial Sweat. Dermatitis : contact, atopic, occupational, drug. 2022 Jul; 33(4):e47-e48. doi: 10.1097/der.0000000000000704. [PMID: 33654019]
  • Elisabeth Eckert, Gabriele Leng, Wolfgang Gries, Thomas Göen. Excretion of mercapturic acids in human urine after occupational exposure to 2-chloroprene. Archives of toxicology. 2013 Jun; 87(6):1095-102. doi: 10.1007/s00204-013-1016-6. [PMID: 23380765]
  • Yuching Yang, Matthew W Himmelstein, Harvey J Clewell. Kinetic modeling of β-chloroprene metabolism: Probabilistic in vitro-in vivo extrapolation of metabolism in the lung, liver and kidneys of mice, rats and humans. Toxicology in vitro : an international journal published in association with BIBRA. 2012 Sep; 26(6):1047-55. doi: 10.1016/j.tiv.2012.04.004. [PMID: 22543297]
  • Elisabeth Eckert, Gabriele Leng, Wolfgang Gries, Thomas Göen. A method for the simultaneous determination of mercapturic acids as biomarkers of exposure to 2-chloroprene and epichlorohydrin in human urine. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2012 Mar; 889-890(?):69-76. doi: 10.1016/j.jchromb.2012.01.032. [PMID: 22342446]
  • Annette Rickert, Benno Hartung, Bernd Kardel, Johanna Teloh, Thomas Daldrup. A fatal intoxication by chloroprene. Forensic science international. 2012 Feb; 215(1-3):110-3. doi: 10.1016/j.forsciint.2011.03.029. [PMID: 21511420]
  • Wenhai Xu, Shane S Que Hee. Swelling of four glove materials challenged by six metalworking fluids. Archives of environmental contamination and toxicology. 2008 Jan; 54(1):1-8. doi: 10.1007/s00244-007-9011-7. [PMID: 17680173]
  • Nurtan A Esmen, Thomas A Hall, Margaret L Phillips, E Paige Jones, Heather Basara, Gary M Marsh, Jeanine M Buchanich. Chemical process-based reconstruction of exposures for an epidemiological study. Part II. Estimated exposures to chloroprene and vinyl chloride. Chemico-biological interactions. 2007 Mar; 166(1-3):264-76. doi: 10.1016/j.cbi.2006.08.010. [PMID: 16989794]
  • Gary M Marsh, Ada O Youk, Jeanine M Buchanich, Michael Cunningham, Nurtan A Esmen, Thomas A Hall, Margaret L Phillips. Mortality patterns among industrial workers exposed to chloroprene and other substances. II. Mortality in relation to exposure. Chemico-biological interactions. 2007 Mar; 166(1-3):301-16. doi: 10.1016/j.cbi.2006.08.012. [PMID: 17007827]
  • Robin C Leonard, Kim H Kreckmann, George A Lineker, Gary Marsh, Jeanine Buchanich, Ada Youk. Comparison of standardized mortality ratios (SMRs) obtained from use of reference populations based on a company-wide registry cohort to SMRs calculated against local and national rates. Chemico-biological interactions. 2007 Mar; 166(1-3):317-22. doi: 10.1016/j.cbi.2006.09.001. [PMID: 17011535]
  • Harrell E Hurst. Toxicology of 1,3-butadiene, chloroprene, and isoprene. Reviews of environmental contamination and toxicology. 2007; 189(?):131-79. doi: 10.1007/978-0-387-35368-5_6. [PMID: 17193739]
  • E Mylchreest, L A Malley, A J O'Neill, T A Kegelman, G P Sykes, R Valentine. Reproductive and developmental toxicity of inhaled 2,3-dichloro-1,3-butadiene in rats. Reproductive toxicology (Elmsford, N.Y.). 2006 Nov; 22(4):613-22. doi: 10.1016/j.reprotox.2006.04.002. [PMID: 16716565]
  • Matthew W Himmelstein, Steven C Carpenter, Marina V Evans, Paul M Hinderliter, Elaina M Kenyon. Kinetic modeling of beta-chloroprene metabolism: II. The application of physiologically based modeling for cancer dose response analysis. Toxicological sciences : an official journal of the Society of Toxicology. 2004 May; 79(1):28-37. doi: 10.1093/toxsci/kfh096. [PMID: 14976335]
  • R L Melnick, R C Sills. Comparative carcinogenicity of 1,3-butadiene, isoprene, and chloroprene in rats and mice. Chemico-biological interactions. 2001 Jun; 135-136(?):27-42. doi: 10.1016/s0009-2797(01)00213-7. [PMID: 11397379]
  • D Zaridze, M Bulbulyan, O Changuina, A Margaryan, P Boffetta. Cohort studies of chloroprene-exposed workers in Russia. Chemico-biological interactions. 2001 Jun; 135-136(?):487-503. doi: 10.1016/s0009-2797(01)00184-3. [PMID: 11397408]
  • M Colonna, G Laydevant. A cohort study of workers exposed to chloroprene in the department of Isère, France. Chemico-biological interactions. 2001 Jun; 135-136(?):505-14. doi: 10.1016/s0009-2797(01)00185-5. [PMID: 11397409]
  • R M Arutyunyan, V S Pogosyan, E H Simonyan, A L Atoyants, E M Djigardjian. In situ monitoring of the ambient air around the chloroprene rubber industrial plant using the Tradescantia-stamen-hair mutation assay. Mutation research. 1999 May; 426(2):117-20. doi: 10.1016/s0027-5107(99)00052-4. [PMID: 10350582]
  • R L Melnick, R C Sills, C J Portier, J H Roycroft, B J Chou, S L Grumbein, R A Miller. Multiple organ carcinogenicity of inhaled chloroprene (2-chloro-1,3-butadiene) in F344/N rats and B6C3F1 mice and comparison of dose-response with 1,3-butadiene in mice. Carcinogenesis. 1999 May; 20(5):867-78. doi: 10.1093/carcin/20.5.867. [PMID: 10334205]
  • M A Bulbulyan, A G Margaryan, S A Ilychova, S V Astashevsky, S M Uloyan, V Y Cogan, D Colin, P Boffetta, D G Zaridze. Cancer incidence and mortality in a cohort of chloroprene workers from Armenia. International journal of cancer. 1999 Mar; 81(1):31-3. doi: 10.1002/(sici)1097-0215(19990331)81:1<31::aid-ijc6>3.0.co;2-t. [PMID: 10077148]
  • M A Bulbulyan, O V Changuina, D G Zaridze, S V Astashevsky, D Colin, P Boffetta. Cancer mortality among Moscow shoe workers exposed to chloroprene (Russia). Cancer causes & control : CCC. 1998 Aug; 9(4):381-7. doi: 10.1023/a:1008863516506. [PMID: 9794169]
  • R L Melnick, M R Elwell, J H Roycroft, B J Chou, H A Ragan, R A Miller. Toxicity of inhaled chloroprene (2-chloro-1,3-butadiene) in F344 rats and B6C3F(1) mice. Toxicology. 1996 Apr; 108(1-2):79-91. doi: 10.1016/0300-483x(95)03286-o. [PMID: 8644121]
  • R Zhang, L F Zhong, Y X Xia. Protective effect of vitamin E on liver damage induced by 2-chloro-1, 3-butadiene. Biomedical and environmental sciences : BES. 1996 Mar; 9(1):71-80. doi: NULL. [PMID: 8721631]
  • W W Au, J B Ward, V M Ramanujam, B L Harper, M T Moslen, M S Legator. Genotoxic effects of a sub-acute low-level inhalation exposure to a mixture of carcinogenic chemicals. Mutation research. 1988 Apr; 203(2):103-15. doi: 10.1016/0165-1161(88)90025-8. [PMID: 3352641]
  • J J Gooch, W F Hawn. Biochemical and hematological evaluation of chloroprene workers. Journal of occupational medicine. : official publication of the Industrial Medical Association. 1981 Apr; 23(4):268-72. doi: ". [PMID: 7218065]
  • K H Summer, H Greim. Detoxification of chloroprene (2-chloro-1,3-butadiene) with glutathione in the rat. Biochemical and biophysical research communications. 1980 Sep; 96(2):566-73. doi: 10.1016/0006-291x(80)91393-5. [PMID: 7425999]