2,4-Dinitroanisole (BioDeep_00000173553)

 

Secondary id: BioDeep_00000013888

human metabolite blood metabolite


代谢物信息卡片


2,4-Dinitrophenyl methyl ether

化学式: C7H6N2O5 (198.0276706)
中文名称: 2,4-二硝基苯甲醚
谱图信息: 最多检出来源 Homo sapiens(blood) 0.16%

分子结构信息

SMILES: COC1=C(C=C(C=C1)N(=O)=O)N(=O)=O
InChI: InChI=1S/C7H6N2O5/c1-14-7-3-2-5(8(10)11)4-6(7)9(12)13/h2-4H,1H3

描述信息

同义名列表

11 个代谢物同义名

2,4-Dinitrophenyl methyl ether; 2,4-Dinitro-1-methoxy-benzene; 2,4-Dinitrophenylmethyl ether; 1-Methoxy-2,4-dinitrobenzene; 4,6-Dinitro-O-cresol; alpha-Dinitroanisole; 2,4-DINITROANISOLE; Α-dinitroanisole; 2,4-Nitroanisole; a-Dinitroanisole; Dinitroanisole



数据库引用编号

10 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

  • Emily May Lent, Anna B Mullins, Anthony D May, Cary L Honnold, Kenneth E Despain. Characterization of the Testicular Toxicity of 3-Nitro-1,2,4-Triazol-5-One and 2,4-Dinitroanisole in Rats ( Rattus norvegicus). International journal of toxicology. 2018 Sep; 37(5):364-372. doi: 10.1177/1091581818789878. [PMID: 30134751]
  • Hunter W Schroer, Xueshu Li, Hans-Joachim Lehmler, Craig L Just. Metabolism and Photolysis of 2,4-Dinitroanisole in Arabidopsis. Environmental science & technology. 2017 Dec; 51(23):13714-13722. doi: 10.1021/acs.est.7b04220. [PMID: 29131608]
  • Tifany L Torralba-Sanchez, Dave T F Kuo, Herbert E Allen, Dominic M Di Toro. Bioconcentration factors and plant-water partition coefficients of munitions compounds in barley. Chemosphere. 2017 Dec; 189(?):538-546. doi: 10.1016/j.chemosphere.2017.09.052. [PMID: 28961539]
  • Lisa M Sweeney, Michelle R Goodwin, Angela D Hulgan, Chester P Gut, Desmond I Bannon. Toxicokinetic Model Development for the Insensitive Munitions Component 2,4-Dinitroanisole. International journal of toxicology. 2015 Sep; 34(5):417-32. doi: 10.1177/1091581815594623. [PMID: 26173616]
  • A L Russell, J M Seiter, J G Coleman, B Winstead, A J Bednar. Analysis of munitions constituents in IMX formulations by HPLC and HPLC-MS. Talanta. 2014 Oct; 128(?):524-30. doi: 10.1016/j.talanta.2014.02.013. [PMID: 25059196]
  • Thomas Richard, Jennifer Weidhaas. Dissolution, sorption, and phytoremediation of IMX-101 explosive formulation constituents: 2,4-dinitroanisole (DNAN), 3-nitro-1,2,4-triazol-5-one (NTO), and nitroguanidine. Journal of hazardous materials. 2014 Sep; 280(?):561-9. doi: 10.1016/j.jhazmat.2014.08.042. [PMID: 25212590]
  • Nathan Hoyt, Marla Brunell, Karl Kroeck, Mike Hable, Lee Crouse, Art O'Neill, Desmond I Bannon. Biomarkers of oral exposure to 3-nitro-1,2,4-triazol-5-one (NTO) and 2,4-dinitroanisole (DNAN) in blood and urine of rhesus macaques (Macaca mulatta). Biomarkers : biochemical indicators of exposure, response, and susceptibility to chemicals. 2013 Nov; 18(7):587-94. doi: 10.3109/1354750x.2013.829522. [PMID: 24001308]
  • Adcharee Karnjanapiboonwong, Ruipu Mu, Yuan Yuan, Honglan Shi, Yinfa Ma, Joel G Burken. Plant tissue analysis for explosive compounds in phytoremediation and phytoforensics. Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering. 2012; 47(14):2219-29. doi: 10.1080/10934529.2012.707540. [PMID: 22934993]