2,6-Dichloro-4-nitroaniline (BioDeep_00000001778)

   

human metabolite blood metabolite Volatile Flavor Compounds


代谢物信息卡片


1-Amino-2,6-dichloro-4-nitrobenzene

化学式: C6H4Cl2N2O2 (205.96498240000003)
中文名称: 2,6-二氯-4-硝基苯胺
谱图信息: 最多检出来源 Homo sapiens(blood) 25.64%

分子结构信息

SMILES: C1=C(C=C(C(=C1Cl)N)Cl)[N+](=O)[O-]
InChI: InChI=1S/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2

描述信息

CONFIDENCE standard compound; INTERNAL_ID 179; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4225; ORIGINAL_PRECURSOR_SCAN_NO 4224
CONFIDENCE standard compound; INTERNAL_ID 179; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4174; ORIGINAL_PRECURSOR_SCAN_NO 4172
CONFIDENCE standard compound; INTERNAL_ID 179; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4176; ORIGINAL_PRECURSOR_SCAN_NO 4174
CONFIDENCE standard compound; INTERNAL_ID 179; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4190; ORIGINAL_PRECURSOR_SCAN_NO 4188
KEIO_ID D048

同义名列表

17 个代谢物同义名

1-Amino-2,6-dichloro-4-nitrobenzene; 2,6-Dichloro-4-nitrobenzenamine; 2,6-DICHLORO-4-NITROANILINE; 4-Nitro-2,6-dichloroaniline; 2,6-Dichlor-4-nitroaniline; Dichloran; Dicloran; Ditranil; Resisan; Bortran; Allisan; Batran; Alizan; Botran; DCNA; CNA; Dichloran



数据库引用编号

22 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

  • Dana Boyd Barr, Cande V Ananth, Xiaoyong Yan, Susan Lashley, John C Smulian, Thomas A Ledoux, Paromita Hore, Mark G Robson. Pesticide concentrations in maternal and umbilical cord sera and their relation to birth outcomes in a population of pregnant women and newborns in New Jersey. The Science of the total environment. 2010 Jan; 408(4):790-5. doi: 10.1016/j.scitotenv.2009.10.007. [PMID: 19900697]
  • Soon Gyu Hong, Barry M Pryor. Development of selective media for the isolation and enumeration of Alternaria species from soil and plant debris. Canadian journal of microbiology. 2004 Jul; 50(7):461-8. doi: 10.1139/w04-036. [PMID: 15381969]
  • Claudio Altomare, Raffaele Pengue, Mara Favilla, Antonio Evidente, Angelo Visconti. Structure-activity relationships of derivatives of fusapyrone, an antifungal metabolite of Fusarium semitectum. Journal of agricultural and food chemistry. 2004 May; 52(10):2997-3001. doi: 10.1021/jf035233z. [PMID: 15137845]
  • C I Rumbos, R A Sikora, S Kiewnick. Risk assessment of biocontrol products: a semi-selective medium for improving quantitative isolation of Paecilomyces lilacinus (strain 251) from soil. Communications in agricultural and applied biological sciences. 2003; 68(4 Pt A):145-8. doi: ". [PMID: 15149104]
  • A I Grudianov, V V Ovchinnikova, L E Serebriakova. [Relationship between salivary lipid peroxidation and the strategy of local dichloran gel treatment for periodontitis]. Stomatologiia. 2002; 81(4):31-4. doi: ". [PMID: 12380294]
  • D E Wedge, D G Nagle. A new 2D-TLC bioautography method for the discovery of novel antifungal agents To control plant pathogens. Journal of natural products. 2000 Aug; 63(8):1050-4. doi: 10.1021/np990628r. [PMID: 10978195]
  • L Gómez-Gómez, P Carrasco. Hormonal regulation of S-adenosylmethionine synthase transcripts in pea ovaries. Plant molecular biology. 1996 Feb; 30(4):821-32. doi: 10.1007/bf00019014. [PMID: 8624412]
  • P S Jaglan, T S Arnold. Metabolism of [14C]dichloran (2,6-dichloro-4-nitroaniline) in the lactating goat. Journal of agricultural and food chemistry. 1982 Nov; 30(6):1051-6. doi: 10.1021/jf00114a012. [PMID: 7175034]