1-Chloro-3-nitrobenzene (BioDeep_00000012788)
Secondary id: BioDeep_00001868235
human metabolite blood metabolite Volatile Flavor Compounds
代谢物信息卡片
化学式: C6H4ClNO2 (156.9930554)
中文名称: 间氯硝基苯, 1-氯-3-硝基苯
谱图信息:
最多检出来源 Rattus norvegicus(blood) 3.51%
分子结构信息
SMILES: C1=CC(=CC(=C1)Cl)[N+](=O)[O-]
InChI: InChI=1S/C6H4ClNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H
描述信息
同义名列表
20 个代谢物同义名
Ortho-chloronitrobenzene; 1-Chloro-3-nitrobenzene; 1-Chloro-2-nitrobenzene; Metachloronitrobenzene; Chloro-m-nitrobenzene; 3-chloro-nitrobenzene; m-Chloronitrobenzene; 3-Nitrochlorobenzene; O-Nitrochlorobenzene; 2-Chloronitrobenzene; 5-Chloronitrobenzene; 3-Chloronitrobenzene; 1-Chloronitrobenzene; m-Nitrochlorobenzene; O-Chloronitrobenzene; Chloronitrobenzene; Terrafun; ONCB; 1-Chloro-3-nitrobenzene; 1-Chloro-3-nitrobenzene
数据库引用编号
12 个数据库交叉引用编号
- ChEBI: CHEBI:82420
- KEGG: C19364
- PubChem: 8489
- HMDB: HMDB0243845
- Metlin: METLIN73068
- ChEMBL: CHEMBL166812
- MetaCyc: CPD-18107
- chemspider: 21106013
- CAS: 121-73-3
- PMhub: MS000027117
- PubChem: 124490036
- KNApSAcK: 82420
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
- Antonio Ariza, Jens M Eklöf, Oliver Spadiut, Wendy A Offen, Shirley M Roberts, Werner Besenmatter, Esben P Friis, Michael Skjøt, Keith S Wilson, Harry Brumer, Gideon Davies. Structure and activity of Paenibacillus polymyxa xyloglucanase from glycoside hydrolase family 44.
The Journal of biological chemistry.
2011 Sep; 286(39):33890-900. doi:
10.1074/jbc.m111.262345
. [PMID: 21795708] - Koreaki Sugimoto, Aya Kanai, Noriaki Shoji. The effectiveness of the Uchida-Kraepelin test for psychological stress: an analysis of plasma and salivary stress substances.
BioPsychoSocial medicine.
2009 Apr; 3(?):5. doi:
10.1186/1751-0759-3-5
. [PMID: 19341484] - Haizhen Wu, Chaohai Wei, Yaqin Wang, Qincong He, Shizhong Liang. Degradation of o-chloronitrobenzene as the sole carbon and nitrogen sources by Pseudomonas putida OCNB-1.
Journal of environmental sciences (China).
2009; 21(1):89-95. doi:
10.1016/s1001-0742(09)60016-4
. [PMID: 19402405] - Michiharu Matsumoto, Yumi Umeda, Hideki Senoh, Masaaki Suzuki, Hirokazu Kano, Taku Katagiri, Shigetoshi Aiso, Kazunori Yamazaki, Heihaciro Arito, Kasuke Nagano, Seigo Yamamoto, Taijiro Matsushima. Two-year feed study of carcinogenicity and chronic toxicity of ortho-chloronitrobenzene in rats and mice.
The Journal of toxicological sciences.
2006 Aug; 31(3):247-64. doi:
10.2131/jts.31.247
. [PMID: 16960435] - Michiharu Matsumoto, Shigetoshi Aiso, Yumi Umeda, Heihachiro Arito, Kasuke Nagano, Seigo Yamamoto, Taijiro Matsushima. Thirteen-week oral toxicity of para- and ortho- chloronitrobenzene in rats and mice.
The Journal of toxicological sciences.
2006 Feb; 31(1):9-22. doi:
10.2131/jts.31.9
. [PMID: 16538040] - Christopher R Jones, Yu-Ying Liu, Ovnair Sepai, Huifang Yan, Gabriele Sabbioni. Internal exposure, health effects, and cancer risk of humans exposed to chloronitrobenzene.
Environmental science & technology.
2006 Jan; 40(1):387-94. doi:
10.1021/es050693p
. [PMID: 16433376] - A V Paranich, L I Paranich, E V Bugaĭ, L F Ortis. [The protective action of tocopherol acetate in simultaneous administration with nitrobenzene and its chloro derivatives].
Likars'ka sprava.
1998 May; ?(3):31-5. doi:
NULL
. [PMID: 9695557] - G S Travlos, J Mahler, H A Ragan, B J Chou, J R Bucher. Thirteen-week inhalation toxicity of 2- and 4-chloronitrobenzene in F344/N rats and B6C3F1 mice.
Fundamental and applied toxicology : official journal of the Society of Toxicology.
1996 Mar; 30(1):75-92. doi:
10.1006/faat.1996.0045
. [PMID: 8812232] - A V Paranich, L I Paranich, N M Vasylenko, O V Buhaĭ, L V Butenko, I V Sysa, T L Optis. [Effect of nitrobenzene and its chlorine derivatives on antioxidative homeostasis].
Fiziolohichnyi zhurnal (Kiev, Ukraine : 1994).
1994 Mar; 40(2):82-7. doi:
. [PMID: 7758610]
- A V Paranich, L I Paranich, O V Buhaĭ, L F Ortys. [Protective effect of vitamin E in acute administration of nitrobenzene and its chlorine derivatives into the stomach of rats].
Fiziolohichnyi zhurnal (Kiev, Ukraine : 1994).
1994 Jan; 40(1):94-100. doi:
NULL
. [PMID: 7713233] - L I Paranich, A V Paranich, N M Vasilenko, E V Bugaĭ. [The action of nitrobenzene and its chlorine derivatives on the indices of antioxidative homeostasis in rat tissues].
Biulleten' eksperimental'noi biologii i meditsiny.
1993 Oct; 116(10):402-5. doi:
. [PMID: 8117965]
- A A Nomeir, P M Markham, A L Mongan, D M Silveira, M Chadwick. Effect of dose on the percutaneous absorption of 2- and 4-chloronitrobenzene in rats.
Drug metabolism and disposition: the biological fate of chemicals.
1992 May; 20(3):436-9. doi:
NULL
. [PMID: 1355721]