Tembotrione (BioDeep_00000271598)

   


代谢物信息卡片


Tembotrione

化学式: C17H16ClF3O6S (440.0308182)
中文名称: 2-{2-氯-4-甲磺酰基-3-[(2,2,2-三氟乙氧基)甲基]苯甲酰基}环己烷-1,3-二酮
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F
InChI: InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3

描述信息

CONFIDENCE standard compound; INTERNAL_ID 339; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4471; ORIGINAL_PRECURSOR_SCAN_NO 4470
CONFIDENCE standard compound; INTERNAL_ID 339; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4415; ORIGINAL_PRECURSOR_SCAN_NO 4410
CONFIDENCE standard compound; INTERNAL_ID 339; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4505; ORIGINAL_PRECURSOR_SCAN_NO 4504
CONFIDENCE standard compound; INTERNAL_ID 339; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4421; ORIGINAL_PRECURSOR_SCAN_NO 4419
CONFIDENCE standard compound; INTERNAL_ID 339; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4503; ORIGINAL_PRECURSOR_SCAN_NO 4501
CONFIDENCE standard compound; INTERNAL_ID 339; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4477; ORIGINAL_PRECURSOR_SCAN_NO 4476
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3177

同义名列表

1 个代谢物同义名

Tembotrione



数据库引用编号

24 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。



文献列表

  • Susee Sudhakar, Sridevi Nakka, Asif Mohammad, Harold N Trick, P V Vara Prasad, Mithila Jugulam. Metabolism of Tembotrione, a Triketone Herbicide, confers Differential Sensitivity in Winter Wheat (Triticum aestivum). Journal of agricultural and food chemistry. 2024 Apr; 72(13):6931-6941. doi: 10.1021/acs.jafc.3c08852. [PMID: 38514379]
  • Panpan Chen, Chenyang Xu, Yang Qiu, Yi Wang. A novel Zn2+-coordination fluorescence probe for sensing HPPD inhibitors and its application in environmental media and biological imaging. Ecotoxicology and environmental safety. 2024 Mar; 273(?):116144. doi: 10.1016/j.ecoenv.2024.116144. [PMID: 38412630]
  • Xu Dong, Zihao Chen, Yue Chu, Zhou Tong, Tongchun Gao, Jinsheng Duan, Minghua Wang. Degradation, adsorption, and bioaccumulation of novel triketone HPPD herbicide tembotrione. Environmental science and pollution research international. 2023 Jun; 30(28):72389-72397. doi: 10.1007/s11356-023-27501-4. [PMID: 37170049]
  • Panpan Chen, Mengchen Shi, Mengyuan Niu, Yuxin Zhang, Rui Wang, Jing Xu, Yi Wang. Effects of HPPD inhibitor herbicides on soybean root exudates: A combination study of multispectral technique and 2D-COS analysis. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy. 2023 Mar; 289(?):122241. doi: 10.1016/j.saa.2022.122241. [PMID: 36529042]
  • P V Silva, B F Schedenffeldt, E S Medeiros, D Z Molina, M K Pagliarini, P A V Salmazo, M Mauad, P A Monquero, F C Munaro, L Y Shirota, G P Silva, M S Monteiro, R D C Dias, R P N Borges. Selectivity of herbicides used in corn on Crotalaria ochroleuca G. Don. Brazilian journal of biology = Revista brasleira de biologia. 2023; 83(?):e277798. doi: 10.1590/1519-6984.277798. [PMID: 38126645]
  • Vedran Mužinić, Anja Katić, Vilena Kašuba, Vedran Micek, Mirta Milić, Davor Želježić. Assessment of transplacental and lactational genotoxicity of tembotrione in Wistar rats at different developmental stages by alkaline comet assay. Toxicology. 2021 11; 463(?):152983. doi: 10.1016/j.tox.2021.152983. [PMID: 34627991]
  • Kai Cui, Xiaohu Wu, Lusheng Zhu, Ying Zhang, Gaochen Dai, Junli Cao, Jun Xu, Fengshou Dong, Xingang Liu, Yongquan Zheng. Development and establishment of a QuEChERS-based extraction method for determining tembotrione and its metabolite AE 1417268 in corn, corn oil and certain animal-origin foods by HPLC-MS/MS. Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment. 2020 Oct; 37(10):1678-1686. doi: 10.1080/19440049.2020.1787526. [PMID: 32787691]
  • Blanka Tariba Lovaković, Vilena Kašuba, Anja Katić, Nevenka Kopjar, Ana Marija Marjanović Čermak, Vedran Micek, Mirta Milić, Ivan Pavičić, Alica Pizent, Suzana Žunec, Davor Želježić. Evaluation of oxidative stress responses and primary DNA damage in blood and brain of rats exposed to low levels of tembotrione. Chemosphere. 2020 Aug; 253(?):126643. doi: 10.1016/j.chemosphere.2020.126643. [PMID: 32278190]
  • Vilena Kašuba, Vedran Micek, Alica Pizent, Blanka Tariba Lovaković, Davor Želježić, Mirta Milić, Nevenka Kopjar. DNA damage in kidney and parenchymal and non-parenchymal liver cells of adult Wistar rats after subchronic oral treatment with tembotrione. Environmental science and pollution research international. 2020 Jan; 27(2):1800-1807. doi: 10.1007/s11356-019-06782-8. [PMID: 31758481]
  • Maxwel C Oliveira, Todd A Gaines, Franck E Dayan, Eric L Patterson, Amit J Jhala, Stevan Z Knezevic. Reversing resistance to tembotrione in an Amaranthus tuberculatus (var. rudis) population from Nebraska, USA with cytochrome P450 inhibitors. Pest management science. 2018 Oct; 74(10):2296-2305. doi: 10.1002/ps.4697. [PMID: 28799707]
  • Anita Küpper, Falco Peter, Peter Zöllner, Lothar Lorentz, Patrick J Tranel, Roland Beffa, Todd A Gaines. Tembotrione detoxification in 4-hydroxyphenylpyruvate dioxygenase (HPPD) inhibitor-resistant Palmer amaranth (Amaranthus palmeri S. Wats.). Pest management science. 2018 Oct; 74(10):2325-2334. doi: 10.1002/ps.4786. [PMID: 29105299]
  • Suzana Žunec, Vilena Kašuba, Ivan Pavičić, Ana Marija Marjanović, Blanka Tariba, Mirta Milić, Nevenka Kopjar, Alica Pizent, Ana Lucić Vrdoljak, Ružica Rozgaj, Davor Želježić. Assessment of oxidative stress responses and the cytotoxic and genotoxic potential of the herbicide tembotrione in HepG2 cells. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association. 2016 Aug; 94(?):64-74. doi: 10.1016/j.fct.2016.05.019. [PMID: 27255802]
  • Amanda F Bontempo, Gabriella D P Carneiro, Fernanda A R Guimarães, Marcelo R Dos Reis, Daniel V Silva, Bruno H Rocha, Matheus F Souza, Tocio Sediyama. Residual tembotrione and atrazine in carrot. Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes. 2016 Jul; 51(7):465-8. doi: 10.1080/03601234.2016.1159458. [PMID: 27052932]