TERBACIL (BioDeep_00000001827)
代谢物信息卡片
化学式: C9H13ClN2O2 (216.0666)
中文名称: 特草定标准溶液
谱图信息:
最多检出来源 Homo sapiens(plant) 10.55%
分子结构信息
SMILES: CC1=C(C(=O)N(C(=O)N1)C(C)(C)C)Cl
InChI: InChI=1S/C9H13ClN2O2/c1-5-6(10)7(13)12(8(14)11-5)9(2,3)4/h1-4H3,(H,11,14)
描述信息
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4035; ORIGINAL_PRECURSOR_SCAN_NO 4030
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4010; ORIGINAL_PRECURSOR_SCAN_NO 4007
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3993; ORIGINAL_PRECURSOR_SCAN_NO 3990
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4017; ORIGINAL_PRECURSOR_SCAN_NO 4012
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4003; ORIGINAL_PRECURSOR_SCAN_NO 3999
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4025; ORIGINAL_PRECURSOR_SCAN_NO 4024
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3179
同义名列表
数据库引用编号
22 个数据库交叉引用编号
- ChEBI: CHEBI:9447
- KEGG: C10963
- PubChem: 22188
- Metlin: METLIN68727
- ChEMBL: CHEMBL1901822
- CAS: 5902-51-2
- MoNA: LU134756
- MoNA: LU134754
- MoNA: LU134753
- MoNA: EQ317951
- MoNA: EQ317952
- MoNA: EQ317955
- MoNA: EQ317956
- MoNA: LU134752
- MoNA: EQ317954
- MoNA: LU134751
- MoNA: EQ317953
- MoNA: LU134755
- PMhub: MS000001243
- PubChem: 13146
- NIKKAJI: J3.079A
- KNApSAcK: 9447
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 |
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文献列表
- Tania Portolés, Elena Pitarch, Francisco J López, Félix Hernández. Development and validation of a rapid and wide-scope qualitative screening method for detection and identification of organic pollutants in natural water and wastewater by gas chromatography time-of-flight mass spectrometry.
Journal of chromatography. A.
2011 Jan; 1218(2):303-15. doi:
10.1016/j.chroma.2010.11.010
. [PMID: 21134677] - E Pitarch, T Portolés, J M Marín, M Ibáñez, F Albarrán, F Hernández. Analytical strategy based on the use of liquid chromatography and gas chromatography with triple-quadrupole and time-of-flight MS analyzers for investigating organic contaminants in wastewater.
Analytical and bioanalytical chemistry.
2010 Aug; 397(7):2763-76. doi:
10.1007/s00216-010-3692-x
. [PMID: 20428853] - Kee Woong Park, Carol A Mallory-Smith. psbA mutation (Asn266 to Thr) in Senecio vulgaris L. confers resistance to several PS II-inhibiting herbicides.
Pest management science.
2006 Sep; 62(9):880-5. doi:
10.1002/ps.1252
. [PMID: 16791906] - Stanisław Sadło, Ewa Szpyrka, Krystyna Rogozińska, Julian Rupar. [Occurrence of some pesticides residues in peppermint Mentha piperita L. in 2003-2005].
Roczniki Panstwowego Zakladu Higieny.
2006; 57(3):211-6. doi:
. [PMID: 17193741]
- J Tekel, S Tahotná, S Vaverková. Gas chromatographic method for determination of uracil herbicides in roots of Echinacea angustifolia Moench (Asteraceae).
Journal of pharmaceutical and biomedical analysis.
1998 Jan; 16(5):753-8. doi:
10.1016/s0731-7085(97)00118-0
. [PMID: 9535186] - X P Lee, T Kumazawa, K Sato. Rapid extraction and capillary gas chromatography for diazine herbicides in human body fluids.
Forensic science international.
1995 Apr; 72(3):199-207. doi:
10.1016/0379-0738(95)01704-m
. [PMID: 7750875] - H W Hogmire, J E Weaver, J L Brooks. Survey for pesticides in wells associated with apple and peach orchards in West Virginia.
Bulletin of environmental contamination and toxicology.
1990 Jan; 44(1):81-6. doi:
10.1007/bf01702365
. [PMID: 2306542] - L S Jordan, A A Zurqiyah, W A Clerx, J G Leasch. Metabolism of terbacil in orange seedlings.
Archives of environmental contamination and toxicology.
1975; 3(3):268-77. doi:
10.1007/bf02220740
. [PMID: 1190839]