N-Nitrosodibutylamine (BioDeep_00000002472)

 

Secondary id: BioDeep_00001868107

human metabolite blood metabolite Volatile Flavor Compounds


代谢物信息卡片


N-Nitrosodibutylamine (NDBA)

化学式: C8H18N2O (158.1419058)
中文名称: N-亚硝基二丁胺
谱图信息: 最多检出来源 Homo sapiens(blood) 6.25%

分子结构信息

SMILES: CCCCN(CCCC)N=O
InChI: InChI=1S/C8H18N2O/c1-3-5-7-10(9-11)8-6-4-2/h3-8H2,1-2H3

描述信息

CONFIDENCE standard compound; EAWAG_UCHEM_ID 3460
D009676 - Noxae > D002273 - Carcinogens

同义名列表

9 个代谢物同义名

N-Nitrosodibutylamine (NDBA); N-Nitrosodi-N-butylamine; N,N-Dibutylnitrosoamine; N,N-Dibutylnitrosamine; dibutyl(nitroso)amine; N-Nitrosodibutylamine; Nitrosodibutylamine; Dibutylnitrosamine; N-Nitrosodi-n-butylamine



数据库引用编号

17 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)

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

  • Chao Zhao, Qiang Lu, Yun Gu, Enchun Pan, Zhongming Sun, Hu Zhang, Jingjing Zhou, Ying Du, Ying Zhang, Yuanmei Feng, Ran Liu, Yuepu Pu, Lihong Yin. Distribution of N-nitrosamines in drinking water and human urinary excretions in high incidence area of esophageal cancer in Huai'an, China. Chemosphere. 2019 Nov; 235(?):288-296. doi: 10.1016/j.chemosphere.2019.06.124. [PMID: 31260869]
  • Minju Lee, Yunho Lee, Fabian Soltermann, Urs von Gunten. Analysis of N-nitrosamines and other nitro(so) compounds in water by high-performance liquid chromatography with post-column UV photolysis/Griess reaction. Water research. 2013 Sep; 47(14):4893-903. doi: 10.1016/j.watres.2013.05.031. [PMID: 23891540]
  • Xiao-Lin Liu, Wei-Wei Zheng, Xiao Wei, Han-Yi Chen, Xia Wang, Hong-Mei Zhang, Song-Hui Jiang, Geng-Sheng He, Wei-Dong Qu. [Investigation on the levels of carbon-, nitrogen-, iodine-containing disinfection by-products in a water plant in Jiangsu province, China]. Zhonghua yu fang yi xue za zhi [Chinese journal of preventive medicine]. 2012 Feb; 46(2):133-8. doi: . [PMID: 22490195]
  • Anna Llop, Francesc Borrull, Eva Pocurull. Pressurised hot water extraction followed by headspace solid-phase microextraction and gas chromatography-tandem mass spectrometry for the determination of N-nitrosamines in sewage sludge. Talanta. 2012 Jan; 88(?):284-9. doi: 10.1016/j.talanta.2011.10.042. [PMID: 22265500]
  • Luigi Robbiano, Roberto Carrozzino, Marianna Bacigalupo, Carlo Corbu, Giovanni Brambilla. Correlation between induction of DNA fragmentation in urinary bladder cells from rats and humans and tissue-specific carcinogenic activity. Toxicology. 2002 Sep; 179(1-2):115-28. doi: 10.1016/s0300-483x(02)00354-2. [PMID: 12204548]
  • H Nanba. Activity of maitake D-fraction to inhibit carcinogenesis and metastasis. Annals of the New York Academy of Sciences. 1995 Sep; 768(?):243-5. doi: 10.1111/j.1749-6632.1995.tb12130.x. [PMID: 8526356]
  • J J Jang, K J Cho, Y S Lee, J H Bae. Modifying responses of allyl sulfide, indole-3-carbinol and germanium in a rat multi-organ carcinogenesis model. Carcinogenesis. 1991 Apr; 12(4):691-5. doi: 10.1093/carcin/12.4.691. [PMID: 2013133]
  • J J Jang, K J Cho, Y S Lee, J H Bae. Different modifying responses of capsaicin in a wide-spectrum initiation model of F344 rat. Journal of Korean medical science. 1991 Mar; 6(1):31-6. doi: 10.3346/jkms.1991.6.1.31. [PMID: 1888447]
  • M Bonfanti, C Magagnotti, A Galli, R Bagnati, M Moret, P Gariboldi, R Fanelli, L Airoldi. Determination of O6-butylguanine in DNA by immunoaffinity extraction/gas chromatography-mass spectrometry. Cancer research. 1990 Nov; 50(21):6870-5. doi: NULL. [PMID: 2208155]
  • J Schulze, E Richter, R M Philpot. Tissue, species, and substrate concentration differences in the position-selective hydroxylation of N-nitrosodibutylamine. Relationship to the distribution of cytochrome P-450 isozymes 2 (IIB) and 5 (IVB). Drug metabolism and disposition: the biological fate of chemicals. 1990 Jul; 18(4):398-402. doi: NULL. [PMID: 1976059]
  • F Theuring, C Balint, W Meier. [Proliferation kinetics in rat urothelium after unilateral nephrectomy and various doses of dibutylnitrosamine application--an example of the roles of a one kidney state on carcinogenesis]. Acta histochemica. Supplementband. 1990; 39(?):267-72. doi: NULL. [PMID: 2080271]
  • C Bornhof, G Wolfrath, J Giedl. [Induction of urinary bladder urothelial cancers in the rabbit by dibutylnitrosamine with an artificial bladder calculus as cocarcinogen]. Der Urologe. Ausg. A. 1989 Nov; 28(6):339-43. doi: . [PMID: 2603278]
  • L Airoldi, M Bonfanti, C Magagnotti, R Fanelli. Development of an experimental model for studying bladder carcinogen metabolism using the isolated rat urinary bladder. Cancer research. 1987 Jul; 47(14):3697-700. doi: . [PMID: 3594434]
  • E Suzuki, M Osabe, M Okada, T Ishizaka, T Suzuki. Urinary metabolites of N-nitrosodibutylamine and N-nitrodibutylamine in the rat: identification of N-acetyl-S-alkyl-L-cysteines. Japanese journal of cancer research : Gann. 1987 Apr; 78(4):382-5. doi: . [PMID: 3108218]
  • E Richter, J Schulze, W Zwickenpflug. Extrahepatic microsomal metabolism of N-nitrosodi-n-butylamine in rats. IARC scientific publications. 1987; ?(84):156-8. doi: . [PMID: 3679357]
  • E Suzuki, M Osabe, M Okada, T Ishizaka, T Suzuki. Urinary metabolites of N-nitrosodibutylamine in the rat: identification of N-acetyl-S-butyl-L-cysteine derivatives. IARC scientific publications. 1987; ?(84):153-5. doi: . [PMID: 3679356]
  • J Gottfried-Anacker, R Preussmann, G Eisenbrand, C Janzowski. Fluoro-substituted N-nitrosamines. 8. N-Nitrosodibutylamine and omega-fluorinated analogues: in vivo metabolism in relation to the induction of urinary bladder cancer in the rat. Carcinogenesis. 1985 Nov; 6(11):1559-64. doi: 10.1093/carcin/6.11.1559. [PMID: 4053275]
  • E Suzuki, M Okada. Metabolic fate of omega-1 and omega-2 oxidized N-nitrosodibutylamines in the rat. Japanese journal of cancer research : Gann. 1985 Mar; 76(3):173-83. doi: . [PMID: 3922835]
  • K E Appel, C S Rühl, A G Hildebrandt. Metabolic inactivation of N-nitrosamines by cytochrome P-450 in vitro and in vivo. IARC scientific publications. 1984; ?(57):443-51. doi: . [PMID: 6533036]
  • L Airoldi, C Spagone, A Macri, R Fanelli. Experimental model for evaluating animal exposure to endogenous N-nitrosodi-n-butylamine by measuring its urinary metabolites N-butyl-N-(4-hydroxybutyl)-nitrosamine and N-butyl-N-(3-carboxypropyl)nitrosamine. IARC scientific publications. 1984; ?(57):237-40. doi: . [PMID: 6533013]
  • L Airoldi, C Spagone, M Bonfanti, C Pantarotto, R Fanelli. Rapid method for quantitative analysis of N,N-dibutylnitrosamine, N-butyl-N-(4-hydroxybutyl)nitrosamine and N-butyl-N-(3-carboxypropyl)-nitrosamine in rat urine by gas chromatography--thermal energy analysis. Journal of chromatography. 1983 Sep; 276(2):402-7. doi: 10.1016/s0378-4347(00)85107-5. [PMID: 6630388]
  • E Suzuki, T Anjo, J Aoki, M Okada. Species variations in the metabolism of N-butyl-N-(4-hydroxybutyl) nitrosamine and related compounds in relation to urinary bladder carcinogenesis. Gan. 1983 Feb; 74(1):60-8. doi: NULL. [PMID: 6840438]
  • E B Brittebo, H Tjälve. Tissue-specificity of N-nitrosodibutylamine metabolism in Sprague-Dawley rats. Chemico-biological interactions. 1982 Jan; 38(2):231-42. doi: 10.1016/0009-2797(82)90042-4. [PMID: 6276033]
  • F Schweinsberg, I Weissenberger, V Burkle. The effect of disulfiram on the carcinogenicity of nitrosamines. IARC scientific publications. 1982; ?(41):649-57. doi: NULL. [PMID: 7141572]
  • E Suzuki, M Okada. Metabolic fate of asymmetric N,N-dialkylnitrosamines having butyl group in the rat. Gan. 1981 Dec; 72(6):910-20. doi: NULL. [PMID: 7341340]
  • E Suzuki, J Aoki, M Okada. Metabolic fate of N-butyl-N-(4-hydroxybutyl) nitrosamine and N, N-dibutylnitrosamine in the guinea pig, with reference to their carcinogenic effects on the urinary bladder. Gan. 1981 Aug; 72(4):547-51. doi: NULL. [PMID: 7308666]
  • E Suzuki, M Okada. Metabolic fate of N,N-dibutylnitrosamine in the rat. Gan. 1980 Dec; 71(6):863-70. doi: NULL. [PMID: 7274631]