Triflumizole (BioDeep_00000002255)

Main id: BioDeep_00000184513

 

natural product


代谢物信息卡片


Pesticide6_Triflumizole_C15H15ClF3N3O_4-Chloro-N-[(1E)-1-(1H-imidazol-1-yl)-2-propoxyethylidene]-2-(trifluoromethyl)benzenamine

化学式: C15H15ClF3N3O (345.0856)
中文名称: 氟菌唑
谱图信息: 最多检出来源 Homo sapiens(not specific) 50%

分子结构信息

SMILES: CCCOCC(=NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2C=CN=C2
InChI: InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3

描述信息

CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4745; ORIGINAL_PRECURSOR_SCAN_NO 4742
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4719; ORIGINAL_PRECURSOR_SCAN_NO 4717
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4736; ORIGINAL_PRECURSOR_SCAN_NO 4734
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4793; ORIGINAL_PRECURSOR_SCAN_NO 4791
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4768; ORIGINAL_PRECURSOR_SCAN_NO 4766
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4866; ORIGINAL_PRECURSOR_SCAN_NO 4864
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9932; ORIGINAL_PRECURSOR_SCAN_NO 9930
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9966; ORIGINAL_PRECURSOR_SCAN_NO 9964
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9898; ORIGINAL_PRECURSOR_SCAN_NO 9896
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9932; ORIGINAL_PRECURSOR_SCAN_NO 9927
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9953; ORIGINAL_PRECURSOR_SCAN_NO 9952
CONFIDENCE standard compound; INTERNAL_ID 1088; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9950; ORIGINAL_PRECURSOR_SCAN_NO 9949

同义名列表

3 个代谢物同义名

Triflumizole; Pesticide6_Triflumizole_C15H15ClF3N3O_4-Chloro-N-[(1E)-1-(1H-imidazol-1-yl)-2-propoxyethylidene]-2-(trifluoromethyl)benzenamine; Triflumizole



数据库引用编号

27 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 ADIG, APAF1, AR, ARHGAP45, CASP3, CASP9, HPGDS, PPARG, SKP1, SREBF1
Peripheral membrane protein 3 CYP1B1, GORASP1, SDHB
Endoplasmic reticulum membrane 2 CYP1B1, SREBF1
Nucleus 10 ADIG, APAF1, AR, CASP3, CASP9, PPARG, RORA, SKP1, SREBF1, VEZF1
cytosol 9 APAF1, AR, ARHGAP45, CASP3, CASP9, HPGDS, PPARG, SKP1, SREBF1
mitochondrial membrane 1 SDHB
centrosome 1 SKP1
nucleoplasm 9 AR, CASP3, HPGDS, PPARG, RORA, SDHB, SKP1, SREBF1, VEZF1
RNA polymerase II transcription regulator complex 1 PPARG
Cytoplasmic side 1 GORASP1
ruffle membrane 1 ARHGAP45
Multi-pass membrane protein 2 MT-CYB, SREBF1
Golgi apparatus membrane 2 GORASP1, SREBF1
glutamatergic synapse 1 CASP3
Golgi apparatus 1 GORASP1
Golgi membrane 2 GORASP1, SREBF1
mitochondrial inner membrane 2 MT-CYB, SDHB
neuronal cell body 1 CASP3
plasma membrane 3 AR, ARHGAP45, SDHB
Membrane 6 ADIG, APAF1, AR, ARHGAP45, CYP1B1, MT-CYB
extracellular exosome 3 ALDH2, APAF1, BMP3
endoplasmic reticulum 1 SREBF1
extracellular space 3 BMP3, IL17A, MSTN
perinuclear region of cytoplasm 1 PPARG
mitochondrion 5 ALDH2, CASP9, CYP1B1, MT-CYB, SDHB
protein-containing complex 4 APAF1, AR, CASP9, SREBF1
intracellular membrane-bounded organelle 3 CYP1B1, HPGDS, PPARG
Microsome membrane 1 CYP1B1
postsynaptic density 1 CASP3
Secreted 4 ADIG, BMP3, IL17A, MSTN
extracellular region 5 ADIG, APAF1, ARHGAP45, BMP3, IL17A
Single-pass membrane protein 1 ADIG
Mitochondrion matrix 1 ALDH2
mitochondrial matrix 2 ALDH2, SDHB
external side of plasma membrane 1 IL17A
nucleolus 1 RORA
Cell projection, ruffle membrane 1 ARHGAP45
Mitochondrion inner membrane 2 MT-CYB, SDHB
Matrix side 1 SDHB
cis-Golgi network 1 GORASP1
nuclear speck 1 AR
receptor complex 1 PPARG
chromatin 4 AR, PPARG, RORA, SREBF1
nuclear envelope 1 SREBF1
Lipid droplet 1 ADIG
Cytoplasmic vesicle membrane 1 SREBF1
ficolin-1-rich granule lumen 1 APAF1
secretory granule lumen 2 APAF1, ARHGAP45
PcG protein complex 1 SKP1
azurophil granule lumen 1 ARHGAP45
Endoplasmic reticulum-Golgi intermediate compartment membrane 1 GORASP1
respiratory chain complex II (succinate dehydrogenase) 1 SDHB
Golgi apparatus, cis-Golgi network membrane 1 GORASP1
ER to Golgi transport vesicle membrane 1 SREBF1
apoptosome 2 APAF1, CASP9
respiratory chain complex III 1 MT-CYB
death-inducing signaling complex 1 CASP3
Cytoplasmic vesicle, COPII-coated vesicle membrane 1 SREBF1
SCF ubiquitin ligase complex 1 SKP1
[Sterol regulatory element-binding protein 1]: Endoplasmic reticulum membrane 1 SREBF1
[Processed sterol regulatory element-binding protein 1]: Nucleus 1 SREBF1
[Isoform SREBP-1aDelta]: Nucleus 1 SREBF1
[Isoform SREBP-1cDelta]: Nucleus 1 SREBF1
caspase complex 1 CASP9
Cul7-RING ubiquitin ligase complex 1 SKP1


文献列表

  • Lederson Gañán-Betancur, Tobin L Peever, Achour Amiri. No Evidence of Resistance to Trifloxystrobin, Triflumizole, and Boscalid in Podosphaera leucotricha Isolates From U.S. Commercial Apple Orchards. Plant disease. 2021 Sep; 105(9):2356-2365. doi: 10.1094/pdis-12-20-2685-re. [PMID: 33728959]
  • Kojiro Kawada, Yuya Uchida, Ikuo Takahashi, Takahito Nomura, Yasuyuki Sasaki, Tadao Asami, Shunsuke Yajima, Shinsaku Ito. Triflumizole as a Novel Lead Compound for Strigolactone Biosynthesis Inhibitor. Molecules (Basel, Switzerland). 2020 Nov; 25(23):. doi: 10.3390/molecules25235525. [PMID: 33255720]
  • Jiejun Xi, Jian Shao, Yuan Wang, Xiaoqin Wang, Hui Yang, Xinwei Zhang, Dongmei Xiong. Acute toxicity of triflumizole to freshwater green algae Chlorella vulgaris. Pesticide biochemistry and physiology. 2019 Jul; 158(?):135-142. doi: 10.1016/j.pestbp.2019.05.002. [PMID: 31378349]
  • Gang Tang, Wenbing Zhang, Jingyue Tang, Junfan Niu, Jiale Yang, Rong Tang, Hongqiang Dong, You Liang, Laixin Luo, Yongsong Cao. Development of triflumizole ionic liquids containing anions of natural origin for improving the utilization and minimizing the adverse impacts on aquatic ecosystems. The Science of the total environment. 2019 Jun; 670(?):606-612. doi: 10.1016/j.scitotenv.2019.03.249. [PMID: 30909038]
  • Jinghua Niu, Jiye Hu. Dissipation behaviour and dietary risk assessment of boscalid, triflumizole and its metabolite (FM-6-1) in open-field cucumber based on QuEChERS using HPLC-MS/MS technique. Journal of the science of food and agriculture. 2018 Sep; 98(12):4501-4508. doi: 10.1002/jsfa.8975. [PMID: 29479706]
  • Pierre Leroux, Michel Gredt, Florent Remuson, Annie Micoud, Anne-Sophie Walker. Fungicide resistance status in French populations of the wheat eyespot fungi Oculimacula acuformis and Oculimacula yallundae. Pest management science. 2013 Jan; 69(1):15-26. doi: 10.1002/ps.3408. [PMID: 23073993]
  • Tjeerd Blacquière, Guy Smagghe, Cornelis A M van Gestel, Veerle Mommaerts. Neonicotinoids in bees: a review on concentrations, side-effects and risk assessment. Ecotoxicology (London, England). 2012 May; 21(4):973-92. doi: 10.1007/s10646-012-0863-x. [PMID: 22350105]
  • Eveline Snelders, Simone M T Camps, Anna Karawajczyk, Gijs Schaftenaar, Gert H J Kema, Henrich A van der Lee, Corné H Klaassen, Willem J G Melchers, Paul E Verweij. Triazole fungicides can induce cross-resistance to medical triazoles in Aspergillus fumigatus. PloS one. 2012; 7(3):e31801. doi: 10.1371/journal.pone.0031801. [PMID: 22396740]
  • Mi-Young Yoon, Nam Hee Choi, Byung Sun Min, Gyung Ja Choi, Yong Ho Choi, Kyoung Soo Jang, Seong-Sook Han, Byeongjin Cha, Jin-Cheol Kim. Potent in vivo antifungal activity against powdery mildews of pregnane glycosides from the roots of Cynanchum wilfordii. Journal of agricultural and food chemistry. 2011 Nov; 59(22):12210-6. doi: 10.1021/jf2039185. [PMID: 21992072]
  • Hiroyuki Kojima, Fumihiro Sata, Shinji Takeuchi, Tatsuya Sueyoshi, Tadanori Nagai. Comparative study of human and mouse pregnane X receptor agonistic activity in 200 pesticides using in vitro reporter gene assays. Toxicology. 2011 Feb; 280(3):77-87. doi: 10.1016/j.tox.2010.11.008. [PMID: 21115097]
  • Mikio Tsuda, Hiroyuki Itoh, Shigehiro Kato. Evaluation of the systemic activity of simeconazole in comparison with that of other DMI fungicides. Pest management science. 2004 Sep; 60(9):875-80. doi: 10.1002/ps.907. [PMID: 15382501]
  • R Nakaune, K Adachi, O Nawata, M Tomiyama, K Akutsu, T Hibi. A novel ATP-binding cassette transporter involved in multidrug resistance in the phytopathogenic fungus Penicillium digitatum. Applied and environmental microbiology. 1998 Oct; 64(10):3983-8. doi: 10.1128/aem.64.10.3983-3988.1998. [PMID: 9758830]