Trinitrotoluene (BioDeep_00001871362)

Main id: BioDeep_00000003649

 


代谢物信息卡片


2,4,6-TRINITROTOLUENE

化学式: C7H5N3O6 (227.0178)
中文名称: 三硝基甲苯, 2,4,6-三硝基甲苯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChI: InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3

描述信息

D053834 - Explosive Agents

同义名列表

4 个代谢物同义名

2,4,6-TRINITROTOLUENE; Trinitrotoluene; Trinitrotoluene; 2,4,6-Trinitrotoluene



数据库引用编号

12 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)

0 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。

亚细胞结构定位 关联基因列表
Cytoplasm 10 AKT1, ALB, ANG, AXIN2, BRCA1, GJA1, HPGDS, PIK3CA, RUNX2, SNCA
Peripheral membrane protein 1 CYP1B1
Endoplasmic reticulum membrane 2 CYP1B1, GJA1
Nucleus 9 AKT1, ALB, ANG, AXIN2, BRCA1, BRCA2, GJA1, RUNX2, SNCA
cytosol 12 AKT1, ALB, ANG, AXIN2, BRCA2, GJA1, GPT, HPGDS, PIK3CA, RUNX2, SNCA, TNNT1
nuclear body 1 BRCA1
centrosome 3 ALB, AXIN2, BRCA2
nucleoplasm 7 AKT1, BRCA1, BRCA2, GJA1, HPGDS, MNT, RUNX2
Cell membrane 3 AKT1, GJA1, TNF
lamellipodium 2 AKT1, PIK3CA
Cell projection, axon 1 SNCA
Multi-pass membrane protein 2 EMP1, GJA1
Synapse 1 SNCA
cell cortex 2 AKT1, SNCA
cell junction 1 GJA1
cell surface 1 TNF
glutamatergic synapse 1 AKT1
Golgi apparatus 2 ALB, GJA1
Golgi membrane 1 GJA1
growth cone 2 ANG, SNCA
neuronal cell body 3 ANG, SNCA, TNF
postsynapse 2 AKT1, SNCA
Lysosome 1 SNCA
plasma membrane 8 AKT1, AXIN2, BRCA1, EMP1, GJA1, PIK3CA, SNCA, TNF
synaptic vesicle membrane 1 SNCA
Membrane 6 AKT1, BRCA1, BRCA2, CYP1B1, EMP1, SNCA
apical plasma membrane 1 GJA1
axon 1 SNCA
extracellular exosome 3 ALB, BMP3, GPT
endoplasmic reticulum 2 ALB, GJA1
extracellular space 7 ALB, ANG, BMP3, CRP, IL6, SNCA, TNF
perinuclear region of cytoplasm 2 PIK3CA, SNCA
gap junction 1 GJA1
intercalated disc 2 GJA1, PIK3CA
mitochondrion 3 CYP1B1, GJA1, SNCA
protein-containing complex 5 AKT1, ALB, BRCA1, BRCA2, SNCA
intracellular membrane-bounded organelle 3 CYP1B1, GJA1, HPGDS
Microsome membrane 1 CYP1B1
Secreted 6 ALB, ANG, BMP3, CRP, IL6, SNCA
extracellular region 7 ALB, ANG, BMP3, CRP, IL6, SNCA, TNF
anchoring junction 1 ALB
transcription regulator complex 1 RUNX2
Cytoplasm, cytoskeleton, microtubule organizing center, centrosome 1 BRCA2
external side of plasma membrane 1 TNF
actin cytoskeleton 2 ANG, SNCA
beta-catenin destruction complex 1 AXIN2
microtubule cytoskeleton 1 AKT1
nucleolus 1 ANG
cell-cell junction 1 AKT1
recycling endosome 1 TNF
Single-pass type II membrane protein 1 TNF
vesicle 1 AKT1
Membrane raft 2 GJA1, TNF
focal adhesion 1 GJA1
spindle 1 AKT1
basement membrane 1 ANG
Mitochondrion intermembrane space 1 AKT1
mitochondrial intermembrane space 1 AKT1
secretory granule 1 BRCA2
Cell junction, gap junction 1 GJA1
connexin complex 1 GJA1
contractile muscle fiber 1 GJA1
fascia adherens 1 GJA1
intermediate filament 1 GJA1
lateral plasma membrane 1 GJA1
ciliary basal body 2 AKT1, ALB
chromatin 2 MNT, RUNX2
phagocytic cup 1 TNF
supramolecular fiber 1 SNCA
Chromosome 2 ANG, BRCA1
centriole 1 ALB
[Isoform 5]: Cytoplasm 1 BRCA1
Nucleus, nucleolus 1 ANG
spindle pole 1 ALB
chromosome, telomeric region 1 BRCA2
blood microparticle 1 ALB
lateral element 2 BRCA1, BRCA2
Golgi-associated vesicle membrane 1 GJA1
Cytoplasm, Stress granule 1 ANG
cytoplasmic stress granule 1 ANG
ubiquitin ligase complex 1 BRCA1
endoplasmic reticulum lumen 2 ALB, IL6
male germ cell nucleus 1 BRCA1
platelet alpha granule lumen 1 ALB
axon terminus 1 SNCA
phosphatidylinositol 3-kinase complex 1 PIK3CA
phosphatidylinositol 3-kinase complex, class IA 1 PIK3CA
XY body 1 BRCA1
endocytic vesicle 1 ANG
tight junction 1 GJA1
ribonucleoprotein complex 1 BRCA1
intracellular non-membrane-bounded organelle 1 BRCA1
DNA repair complex 2 BRCA1, BRCA2
BRCA1-C complex 1 BRCA1
cell-cell contact zone 1 GJA1
[Tumor necrosis factor, soluble form]: Secreted 1 TNF
troponin complex 1 TNNT1
angiogenin-PRI complex 1 ANG
inclusion body 1 SNCA
interleukin-6 receptor complex 1 IL6
BRCA1-A complex 1 BRCA1
BRCA1-B complex 1 BRCA1
BRCA1-BARD1 complex 1 BRCA1
gamma-tubulin ring complex 1 BRCA1
nuclear ubiquitin ligase complex 2 BRCA1, BRCA2
phosphatidylinositol 3-kinase complex, class IB 1 PIK3CA
ciliary transition fiber 1 ALB
BRCA2-MAGE-D1 complex 1 BRCA2
[C-domain 2]: Secreted 1 TNF
[Tumor necrosis factor, membrane form]: Membrane 1 TNF
[C-domain 1]: Secreted 1 TNF


文献列表

  • Rujia Chen, Yue Lu, Enying Zhang, Zhiyang Chen, Liexiang Huangfu, Zhihao Zuo, Yu Zhao, Minyan Zhu, Zihui Zhang, Mingli Chuan, Qing Bu, Qianfeng Huang, Hanyao Wang, Yang Xu, Pengcheng Li, Youli Yao, Yong Zhou, Chenwu Xu, Zefeng Yang. The plant streptolysin S (SLS)-associated gene B confers nitroaromatic tolerance and detoxification. Journal of hazardous materials. 2022 07; 433(?):128779. doi: 10.1016/j.jhazmat.2022.128779. [PMID: 35364534]
  • Xu Yang, Jin-Long Lai, Yu Zhang, Xue-Gang Luo. Toxicity analysis of TNT to alfalfa's mineral nutrition and secondary metabolism. Plant cell reports. 2022 May; 41(5):1273-1284. doi: 10.1007/s00299-022-02856-z. [PMID: 35305132]
  • Muhammad Aamir, Sobia Irum, Amer Siddiq, Hafiza Monaza Batool, Nisar Ahmed, Muhammad Hamid Awais, Sadiq Ali. A novel method development and validation for determination of 2,4,6-Trinitrotoluene and its metabolites on LC-MS/MS. Analytical biochemistry. 2022 02; 638(?):114496. doi: 10.1016/j.ab.2021.114496. [PMID: 34838816]
  • Aaron J Beck, Martha Gledhill, Mareike Kampmeier, Caiyan Feng, Christian Schlosser, Jens Greinert, Eric P Achterberg. Explosives compounds from sea-dumped relic munitions accumulate in marine biota. The Science of the total environment. 2022 Feb; 806(Pt 4):151266. doi: 10.1016/j.scitotenv.2021.151266. [PMID: 34757098]
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  • Xu Yang, Yu Zhang, Jin-Long Lai, Xue-Gang Luo, Meng-Wei Han, San-Ping Zhao, Yong-Bing Zhu. Analysis of the biodegradation and phytotoxicity mechanism of TNT, RDX, HMX in alfalfa (Medicago sativa). Chemosphere. 2021 Oct; 281(?):130842. doi: 10.1016/j.chemosphere.2021.130842. [PMID: 34023765]
  • Xu Yang, Jin-Long Lai, Yu Zhang, Xue-Gang Luo, Meng-Wei Han, San-Ping Zhao. Microbial community structure and metabolome profiling characteristics of soil contaminated by TNT, RDX, and HMX. Environmental pollution (Barking, Essex : 1987). 2021 Sep; 285(?):117478. doi: 10.1016/j.envpol.2021.117478. [PMID: 34087636]
  • Jian-Jie Gao, Ri-He Peng, Bo Zhu, Yong-Sheng Tian, Jing Xu, Bo Wang, Xiao-Yan Fu, Hong-Juan Han, Li-Juan Wang, Fu-Jian Zhang, Wen-Hui Zhang, Yong-Dong Deng, Yu- Wang, Zhen-Jun Li, Quan-Hong Yao. Enhanced phytoremediation of TNT and cobalt co-contaminated soil by AfSSB transformed plant. Ecotoxicology and environmental safety. 2021 Sep; 220(?):112407. doi: 10.1016/j.ecoenv.2021.112407. [PMID: 34119926]
  • Etai Shpigel, Benjamin Shemer, Tal Elad, Anat Glozman, Shimshon Belkin. Bacterial bioreporters for the detection of trace explosives: performance enhancement by DNA shuffling and random mutagenesis. Applied microbiology and biotechnology. 2021 May; 105(10):4329-4337. doi: 10.1007/s00253-021-11290-2. [PMID: 33942130]
  • Xu Yang, Jin-Long Lai, Jie Li, Yu Zhang, Xue-Gang Luo, Zhan-Guo Li. Biodegradation and physiological response mechanism of a bacterial strain to 2,4,6-trinitrotoluene contamination. Chemosphere. 2021 May; 270(?):129280. doi: 10.1016/j.chemosphere.2020.129280. [PMID: 33418226]
  • Jennifer S Strehse, Matthias Brenner, Michael Kisiela, Edmund Maser. The explosive trinitrotoluene (TNT) induces gene expression of carbonyl reductase in the blue mussel (Mytilus spp.): a new promising biomarker for sea dumped war relicts?. Archives of toxicology. 2020 12; 94(12):4043-4054. doi: 10.1007/s00204-020-02931-y. [PMID: 33094350]
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  • Kurt A Gust, Vijender Chaitankar, Preetam Ghosh, Mitchell S Wilbanks, Xianfeng Chen, Natalie D Barker, Don Pham, Leona D Scanlan, Arun Rawat, Larry G Talent, Michael J Quinn, Christopher D Vulpe, Mohamed O Elasri, Mark S Johnson, Edward J Perkins, Craig A McFarland. Multiple environmental stressors induce complex transcriptomic responses indicative of phenotypic outcomes in Western fence lizard. BMC genomics. 2018 Dec; 19(1):877. doi: 10.1186/s12864-018-5270-0. [PMID: 30518325]
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  • Chelsea K Katseanes, Mark A Chappell, Bryan G Hopkins, Brian D Durham, Cynthia L Price, Beth E Porter, Lesley F Miller. Multivariate soil fertility relationships for predicting the environmental persistence of 2,4,6-trinitrotoluene (TNT) and 1,3,5-trinitro-1,3,5-tricyclohexane (RDX) among taxonomically distinct soils. Journal of environmental management. 2017 Dec; 203(Pt 1):383-390. doi: 10.1016/j.jenvman.2017.08.005. [PMID: 28818710]
  • Long Zhang, Elizabeth L Rylott, Neil C Bruce, Stuart E Strand. Phytodetoxification of TNT by transplastomic tobacco (Nicotiana tabacum) expressing a bacterial nitroreductase. Plant molecular biology. 2017 Sep; 95(1-2):99-109. doi: 10.1007/s11103-017-0639-z. [PMID: 28762129]
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  • Long Zhang, Ryan Routsong, Quyen Nguyen, Elizabeth L Rylott, Neil C Bruce, Stuart E Strand. Expression in grasses of multiple transgenes for degradation of munitions compounds on live-fire training ranges. Plant biotechnology journal. 2017 05; 15(5):624-633. doi: 10.1111/pbi.12661. [PMID: 27862819]
  • Kyriakos Tzafestas, Maria M Razalan, Ivan Gyulev, Aslam M A Mazari, Bengt Mannervik, Elizabeth L Rylott, Neil C Bruce. Expression of a Drosophila glutathione transferase in Arabidopsis confers the ability to detoxify the environmental pollutant, and explosive, 2,4,6-trinitrotoluene. The New phytologist. 2017 Apr; 214(1):294-303. doi: 10.1111/nph.14326. [PMID: 27924627]
  • Stephen M Via, Julie C Zinnert, Donald R Young. Multiple metrics quantify and differentiate responses of vegetation to composition B. International journal of phytoremediation. 2017 Jan; 19(1):56-64. doi: 10.1080/15226514.2016.1216080. [PMID: 27483131]
  • Chelsea K Katseanes, Mark A Chappell, Bryan G Hopkins, Brian D Durham, Cynthia L Price, Beth E Porter, Lesley F Miller. Multivariate functions for predicting the sorption of 2,4,6-trinitrotoluene (TNT) and 1,3,5-trinitro-1,3,5-tricyclohexane (RDX) among taxonomically distinct soils. Journal of environmental management. 2016 Nov; 182(?):101-110. doi: 10.1016/j.jenvman.2016.07.043. [PMID: 27454101]
  • Seok-Young Oh, Hyun-Su Yoon, Tae-Yong Jeong, Sang Don Kim, Dong-Wook Kim. Reduction and persulfate oxidation of nitro explosives in contaminated soils using Fe-bearing materials. Environmental science. Processes & impacts. 2016 Jul; 18(7):863-71. doi: 10.1039/c6em00223d. [PMID: 27327861]
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  • Graham Noctor. PLANT BIOCHEMISTRY. Lighting the fuse on toxic TNT. Science (New York, N.Y.). 2015 Sep; 349(6252):1052-3. doi: 10.1126/science.aad0941. [PMID: 26339013]
  • Emily J Johnston, Elizabeth L Rylott, Emily Beynon, Astrid Lorenz, Victor Chechik, Neil C Bruce. Monodehydroascorbate reductase mediates TNT toxicity in plants. Science (New York, N.Y.). 2015 Sep; 349(6252):1072-5. doi: 10.1126/science.aab3472. [PMID: 26339024]
  • O Chusova, H Nõlvak, M Odlare, J Truu, M Truu, K Oopkaup, E Nehrenheim. Biotransformation of pink water TNT on the surface of a low-cost adsorbent pine bark. Biodegradation. 2015 Sep; 26(5):375-86. doi: 10.1007/s10532-015-9740-7. [PMID: 26142875]
  • Chien-Hsun Chen, Tsung-Chi Chen, Xiaoyu Zhou, Robert Kline-Schoder, Paul Sorensen, R Graham Cooks, Zheng Ouyang. Design of portable mass spectrometers with handheld probes: aspects of the sampling and miniature pumping systems. Journal of the American Society for Mass Spectrometry. 2015 Feb; 26(2):240-7. doi: 10.1007/s13361-014-1026-5. [PMID: 25404157]
  • Elizabeth L Rylott, Vanda Gunning, Kyriakos Tzafestas, Helen Sparrow, Emily J Johnston, Andrew S Brentnall, Jennifer R Potts, Neil C Bruce. Phytodetoxification of the environmental pollutant and explosive 2,4,6-trinitrotoluene. Plant signaling & behavior. 2015; 10(1):e977714. doi: 10.4161/15592324.2014.977714. [PMID: 25654165]
  • Stephen M Via, Julie C Zinnert, Donald R Young. Differential effects of two explosive compounds on seed germination and seedling morphology of a woody shrub, Morella cerifera. Ecotoxicology (London, England). 2015 Jan; 24(1):194-201. doi: 10.1007/s10646-014-1372-x. [PMID: 25336045]
  • Wusong Dong, Rui Yang, Jian Yang, Jun Yang, Jiawang Ding, Hui Wu, Jing Zhang. Resveratrol pretreatment protects rat hearts from ischemia/reperfusion injury partly via a NALP3 inflammasome pathway. International journal of clinical and experimental pathology. 2015; 8(8):8731-41. doi: . [PMID: 26464617]
  • Timothy M Mallon, Jose M Ortiz, William H Candler, Gregory Rogers, Richard Hillburn. Investigation of an outbreak of anemia cases at an Army trinitrotoluene munitions production plant from 2004 to 2005 and subsequent surveillance 2005-2013. Military medicine. 2014 Nov; 179(11):1374-83. doi: 10.7205/milmed-d-14-00278. [PMID: 25373069]
  • Olga Chusova, Hiie Nolvak, Emma Nehrenheim, Jaak Truu, Monica Odlare, Kristjan Oopkaup, Marika Truu. Effect of pine bark on the biotransformation of trinitrotoluene and on the bacterial community structure in a batch experiment. Environmental technology. 2014 Sep; 35(17-20):2456-65. doi: 10.1080/09593330.2014.909888. [PMID: 25145200]
  • Artur Reimer, Sharon Yagur-Kroll, Shimshon Belkin, Shantanu Roy, Jan Roelof van der Meer. Escherichia [corrected] coli ribose binding protein based bioreporters revisited. Scientific reports. 2014 Jul; 4(?):5626. doi: 10.1038/srep05626. [PMID: 25005019]
  • Asjad Ali, Julie C Zinnert, Balasubramaniam Muthukumar, Yanhui Peng, Sang-Min Chung, C Neal Stewart. Physiological and transcriptional responses of Baccharis halimifolia to the explosive 'composition B' (RDX/TNT) in amended soil. Environmental science and pollution research international. 2014; 21(13):8261-70. doi: 10.1007/s11356-014-2764-4. [PMID: 24687782]
  • Padmini Das, Dibyendu Sarkar, Konstantinos C Makris, Pravin Punamiya, Rupali Datta. Effectiveness of urea in enhancing the extractability of 2,4,6-trinitrotoluene from chemically variant soils. Chemosphere. 2013 Nov; 93(9):1811-7. doi: 10.1016/j.chemosphere.2013.06.028. [PMID: 23835412]
  • Jacob K Stanley, Edward J Perkins, Tanwir Habib, Jerre G Sims, Pornsawan Chappell, B Lynn Escalon, Mitchell Wilbanks, Natàlia Garcia-Reyero. The good, the bad, and the toxic: approaching hormesis in Daphnia magna exposed to an energetic compound. Environmental science & technology. 2013 Aug; 47(16):9424-33. doi: 10.1021/es401115q. [PMID: 23898970]
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  • Pornpimol Kongtip, Smart Preklang, Witaya Yoosook, Suttinun Chantanakul. Exposure to trinitrotoluene and health effects among workers in an artillery and ammunition plant. Journal of the Medical Association of Thailand = Chotmaihet thangphaet. 2012 Jun; 95 Suppl 6(?):S154-60. doi: . [PMID: 23130502]
  • Chao Wang, Mark E Fuller, Charles Schaefer, Jeffrey L Caplan, Yan Jin. Dissolution of explosive compounds TNT, RDX, and HMX under continuous flow conditions. Journal of hazardous materials. 2012 May; 217-218(?):187-93. doi: 10.1016/j.jhazmat.2012.03.012. [PMID: 22480704]
  • Olga Muter, Katrina Potapova, Baiba Limane, Kristine Sproge, Ida Jakobsone, Guntis Cepurnieks, Vadims Bartkevics. The role of nutrients in the biodegradation of 2,4,6-trinitrotoluene in liquid and soil. Journal of environmental management. 2012 May; 98(?):51-5. doi: 10.1016/j.jenvman.2011.12.010. [PMID: 22245864]
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