4-Chlorobiphenyl (BioDeep_00000006215)
Secondary id: BioDeep_00001868384
human metabolite blood metabolite
代谢物信息卡片
1-Chloro-4-phenyl benzene
化学式: C12H9Cl (188.0393)
中文名称: 4-氯联苯
谱图信息:
最多检出来源 Homo sapiens(blood) 55.77%
分子结构信息
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)Cl
InChI: InChI=1S/C12H9Cl/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
数据库引用编号
15 个数据库交叉引用编号
- ChEBI: CHEBI:27757
- KEGG: C06584
- PubChem: 16323
- HMDB: HMDB0246395
- Metlin: METLIN66440
- ChEMBL: CHEMBL276334
- chemspider: 15489
- CAS: 51624-37-4
- CAS: 2051-62-9
- PMhub: MS000019231
- PubChem: 8812
- 3DMET: B00982
- NIKKAJI: J47.611K
- RefMet: 4-Chlorobiphenyl
- KNApSAcK: 27757
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
- Kiran Dhakal, Eric Uwimana, Andrea Adamcakova-Dodd, Peter S Thorne, Hans-Joachim Lehmler, Larry W Robertson. Disposition of phenolic and sulfated metabolites after inhalation exposure to 4-chlorobiphenyl (PCB3) in female rats.
Chemical research in toxicology.
2014 Aug; 27(8):1411-20. doi:
10.1021/tx500150h. [PMID: 24988477] - Kiran Dhakal, Andrea Adamcakova-Dodd, Hans-Joachim Lehmler, Peter S Thorne, Larry W Robertson. Sulfate conjugates are urinary markers of inhalation exposure to 4-chlorobiphenyl (PCB3).
Chemical research in toxicology.
2013 Jun; 26(6):853-5. doi:
10.1021/tx4001539. [PMID: 23713983] - Guangshu Zhai, Hans-Joachim Lehmler, Jerald L Schnoor. Sulfate metabolites of 4-monochlorobiphenyl in whole poplar plants.
Environmental science & technology.
2013 Jan; 47(1):557-62. doi:
10.1021/es303807f. [PMID: 23215248] - Kiran Dhakal, Xianran He, Hans-Joachim Lehmler, Lynn M Teesch, Michael W Duffel, Larry W Robertson. Identification of sulfated metabolites of 4-chlorobiphenyl (PCB3) in the serum and urine of male rats.
Chemical research in toxicology.
2012 Dec; 25(12):2796-804. doi:
10.1021/tx300416v. [PMID: 23137097] - Guangshu Zhai, Hans-Joachim Lehmler, Jerald L Schnoor. New hydroxylated metabolites of 4-monochlorobiphenyl in whole poplar plants.
Chemistry Central journal.
2011 Dec; 5(?):87. doi:
10.1186/1752-153x-5-87. [PMID: 22185578] - Guangshu Zhai, Hans-Joachim Lehmler, Jerald L Schnoor. Hydroxylated metabolites of 4-monochlorobiphenyl and its metabolic pathway in whole poplar plants.
Environmental science & technology.
2010 May; 44(10):3901-7. doi:
10.1021/es100230m. [PMID: 20402517] - Anna Ptak, Patrycja Gut, Małgorzata Błachuta, Agnieszka Rak, Ewa Ł Gregoraszczuk. Direct inhibition of ERK1/2 phosphorylation as a possible mechanism for the antiproliferative action of 3,4-diOH-PCB3 in the MCF-7 cell line.
Toxicology letters.
2009 Oct; 190(2):187-92. doi:
10.1016/j.toxlet.2009.07.013. [PMID: 19619627] - Gregor Luthe, Regine Garcia Boy, James Jacobus, Bryan J Smith, Asif Rahaman, Larry W Robertson, Gabriele Ludewig. Xenobiotic geometry and media pH determine cytotoxicity through solubility.
Chemical research in toxicology.
2008 May; 21(5):1017-27. doi:
10.1021/tx700214p. [PMID: 18402468] - Mahmood Mohammadi, Vida Chalavi, Martina Novakova-Sura, Jean-François Laliberté, Michel Sylvestre. Expression of bacterial biphenyl-chlorobiphenyl dioxygenase genes in tobacco plants.
Biotechnology and bioengineering.
2007 Jun; 97(3):496-505. doi:
10.1002/bit.21188. [PMID: 17006888] - Hojjat Sadeghi-Aliabadi, Katie Chan, Hans-Joachim Lehmler, Larry W Robertson, Peter J O'Brien. Molecular cytotoxic mechanisms of catecholic polychlorinated biphenyl metabolites in isolated rat hepatocytes.
Chemico-biological interactions.
2007 May; 167(3):184-92. doi:
10.1016/j.cbi.2007.02.011. [PMID: 17408604] - Ariane Toussaint, Christophe Merlin, Sébastien Monchy, M Abderrafi Benotmane, Raphaël Leplae, Max Mergeay, Dirk Springael. The biphenyl- and 4-chlorobiphenyl-catabolic transposon Tn4371, a member of a new family of genomic islands related to IncP and Ti plasmids.
Applied and environmental microbiology.
2003 Aug; 69(8):4837-45. doi:
10.1128/aem.69.8.4837-4845.2003. [PMID: 12902278] - Jin-ping Qiao, Pei-ling Hou, Ya-wei Li, Zeper Abliz. [Determination of tanshinone IIA in rat plasma and the pharmacokinetics by RP-HPLC method].
Yao xue xue bao = Acta pharmaceutica Sinica.
2003 May; 38(5):368-70. doi:
NULL. [PMID: 12958842] - Nilufer Tampal, Steven Myers, Larry W Robertson. Binding of polychlorinated biphenyls/metabolites to hemoglobin.
Toxicology letters.
2003 Apr; 142(1-2):53-60. doi:
10.1016/s0378-4274(02)00484-8. [PMID: 12765239] - D Pereg, N Tampal, P Espandiari, L W Robertson. Distribution and macromolecular binding of benzo[a]pyrene and two polychlorinated biphenyl congeners in female mice.
Chemico-biological interactions.
2001 Sep; 137(3):243-58. doi:
10.1016/s0009-2797(01)00256-3. [PMID: 11566292] - T P Twaroski, M L O'Brien, N Larmonier, H P Glauert, L W Robertson. Polychlorinated biphenyl-induced effects on metabolic enzymes, AP-1 binding, vitamin E, and oxidative stress in the rat liver.
Toxicology and applied pharmacology.
2001 Mar; 171(2):85-93. doi:
10.1006/taap.2000.9114. [PMID: 11222084] - F N Ko, L J Yeh, H C Liang, S C Kuo, C M Teng. Mechanism of action of p-chlorobiphenyl on the inhibition of platelet aggregation.
The Journal of pharmacy and pharmacology.
1996 Apr; 48(4):395-400. doi:
10.1111/j.2042-7158.1996.tb05940.x. [PMID: 8794990] - M T Scott, J E Sinsheimer. Direct chloride measurement of [4-36Cl]chlorobiphenyl and [4,4'-36Cl]dichlorobiphenyl dechlorination in the rat.
Journal of pharmaceutical sciences.
1984 Aug; 73(8):1171-2. doi:
10.1002/jps.2600730839. [PMID: 6436465] - K Yamamoto, H Yamamoto, T Mizutani. Uptake of 4-chlorobiphenyl and 4,4'-dichlorobiphenyl in six species of plant tissue cultures.
Bulletin of environmental contamination and toxicology.
1982 Jun; 28(6):728-32. doi:
10.1007/bf01605644. [PMID: 6809086] - N S Platonow, E B Meads. Distribution and excretion of two chlorinated biphenyl isomers: 4-chlorobiphenyl and decachlorobiphenyl in lactating bovine.
Canadian journal of comparative medicine : Revue canadienne de medecine comparee.
1975 Jan; 39(1):104-6. doi:
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