Methyl butyrate (BioDeep_00000023185)

 

Secondary id: BioDeep_00000618747, BioDeep_00000871087

human metabolite Endogenous natural product


代谢物信息卡片


Methyl ester OF butanoic acid

化学式: C5H10O2 (102.068076)
中文名称: 丁酸甲酯
谱图信息: 最多检出来源 Escherichia coli(natural_products) 50%

分子结构信息

SMILES: CCCC(=O)OC
InChI: InChI=1S/C5H10O2/c1-3-4-5(6)7-2/h3-4H2,1-2H3

描述信息

Methyl butyrate belongs to the class of organic compounds known as organic acid methyl esters. Organic acid methyl esters are compounds containing an organic acid that is esterified with a methyl group. They have the general structure RC(=O)OR, where R= aliphatic tail or organyl group and R=methyl group. Methyl butyrate is a very hydrophobic molecule, practically insoluble in water, and relatively neutral.
Found in many fruits, e.g. apple juice, apricot, blackberry, nectarine etc., also present in cheeses, butter, milk, white wine, coffee and black tea. Flavouring ingredient

同义名列表

10 个代谢物同义名

Methyl ester OF butanoic acid; Butanoic acid, methyl ester; N-Butyric acid methyl ester; Butyric acid, methyl ester; Methyl butanoic acid; Methyl butyric acid; Methyl N-butanoate; Methyl N-butyrate; Methyl butanoate; Methyl butyrate



数据库引用编号

12 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)

68 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

  • Xiaojuan Li, Lu Zhang, Yankun Zhao, Junting Feng, Yufeng Chen, Kai Li, Miaoyi Zhang, Dengfeng Qi, Dengbo Zhou, Yongzan Wei, Wei Wang, Jianghui Xie. Biocontrol potential of volatile organic compounds produced by Streptomyces corchorusii CG-G2 to strawberry anthracnose caused by Colletotrichum gloeosporioides. Food chemistry. 2024 Mar; 437(Pt 2):137938. doi: 10.1016/j.foodchem.2023.137938. [PMID: 37948803]
  • Geyan Duan, Changbing Zheng, Jiayi Yu, Peiwen Zhang, Mengliao Wan, Jie Zheng, Yehui Duan. β-Hydroxy-β-methyl Butyrate Regulates the Lipid Metabolism, Mitochondrial Function, and Fat Browning of Adipocytes. Nutrients. 2023 May; 15(11):. doi: 10.3390/nu15112550. [PMID: 37299513]
  • Seyed Hamid Mustafavi, Amin Abbasi, Mohammad Reza Morshedloo, Mirian Pateiro, Jose M Lorenzo. Essential Oil Variability in Iranian Populations of Heracleum persicum Desf. ex Fischer: A Rich Source of Hexyl Butyrate and Octyl Acetate. Molecules (Basel, Switzerland). 2022 Sep; 27(19):. doi: 10.3390/molecules27196296. [PMID: 36234832]
  • Mian Chee Gor, Chrishani Candappa, Thishakya de Silva, Nitin Mantri, Edwin Pang. Identification and validation of FaP1D7, a putative marker associated with the biosynthesis of methyl butanoate in cultivated strawberry (Fragaria x ananassa). Scientific reports. 2017 12; 7(1):17454. doi: 10.1038/s41598-017-17448-1. [PMID: 29234071]
  • Mohsin Ali Khan, Rumana Ahmad, A N Srivastava. Effect of methyl butyrate aroma on the survival and viability of human breast cancer cells in vitro. Journal of the Egyptian National Cancer Institute. 2016 Jun; 28(2):81-8. doi: 10.1016/j.jnci.2016.02.005. [PMID: 27106628]
  • Beatrice Vitali, Maurice Ndagijimana, Simone Maccaferri, Elena Biagi, Maria Elisabetta Guerzoni, Patrizia Brigidi. An in vitro evaluation of the effect of probiotics and prebiotics on the metabolic profile of human microbiota. Anaerobe. 2012 Aug; 18(4):386-91. doi: 10.1016/j.anaerobe.2012.04.014. [PMID: 22579985]
  • Ross N Crowhurst, Andrew P Gleave, Elspeth A MacRae, Charles Ampomah-Dwamena, Ross G Atkinson, Lesley L Beuning, Sean M Bulley, David Chagne, Ken B Marsh, Adam J Matich, Mirco Montefiori, Richard D Newcomb, Robert J Schaffer, Björn Usadel, Andrew C Allan, Helen L Boldingh, Judith H Bowen, Marcus W Davy, Rheinhart Eckloff, A Ross Ferguson, Lena G Fraser, Emma Gera, Roger P Hellens, Bart J Janssen, Karin Klages, Kim R Lo, Robin M MacDiarmid, Bhawana Nain, Mark A McNeilage, Maysoon Rassam, Annette C Richardson, Erik Ha Rikkerink, Gavin S Ross, Roswitha Schröder, Kimberley C Snowden, Edwige J F Souleyre, Matt D Templeton, Eric F Walton, Daisy Wang, Mindy Y Wang, Yanming Y Wang, Marion Wood, Rongmei Wu, Yar-Khing Yauk, William A Laing. Analysis of expressed sequence tags from Actinidia: applications of a cross species EST database for gene discovery in the areas of flavor, health, color and ripening. BMC genomics. 2008 Jul; 9(?):351. doi: 10.1186/1471-2164-9-351. [PMID: 18655731]
  • Charlotte M Andersen, Lene T Andersen, Anne Mette Hansen, Leif H Skibsted, Mikael A Petersen. Wavelength dependence of light-induced lipid oxidation and naturally occurring photosensitizers in cheese. Journal of agricultural and food chemistry. 2008 Mar; 56(5):1611-8. doi: 10.1021/jf072672f. [PMID: 18275145]
  • Ana I S Brígida, Alvaro D T Pinheiro, Andrea L O Ferreira, Luciana R B Gonçalves. Immobilization of Candida antarctica lipase B by adsorption to green coconut fiber. Applied biochemistry and biotechnology. 2008 Mar; 146(1-3):173-87. doi: 10.1007/s12010-007-8072-4. [PMID: 18421597]
  • Anders Bach Nielsen, Anders Buur, Claus Larsen. Bioreversible quaternary N-acyloxymethyl derivatives of the tertiary amines bupivacaine and lidocaine--synthesis, aqueous solubility and stability in buffer, human plasma and simulated intestinal fluid. European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences. 2005 Apr; 24(5):433-40. doi: 10.1016/j.ejps.2004.12.007. [PMID: 15784333]
  • R Watson, C J Wright, T McBurney, A J Taylor, R S T Linforth. Influence of harvest date and light integral on the development of strawberry flavour compounds. Journal of experimental botany. 2002 Oct; 53(377):2121-9. doi: 10.1093/jxb/erf088. [PMID: 12324536]
  • T Tsujita, T Miyada, H Okuda. Purification of rat kidney carboxylesterase and its comparison with other tissue esterases. Journal of biochemistry. 1988 Feb; 103(2):327-31. doi: 10.1093/oxfordjournals.jbchem.a122269. [PMID: 3372492]
  • S H Sterri, B A Johnsen, F Fonnum. A radiochemical assay method for carboxylesterase, and comparison of enzyme activity towards the substrates methyl [1-14C] butyrate and 4-nitrophenyl butyrate. Biochemical pharmacology. 1985 Aug; 34(15):2779-85. doi: 10.1016/0006-2952(85)90579-9. [PMID: 4015714]
  • M Sano. Subcellular localizations of guanylate cyclase and 3',5'-cyclic nucleotide phosphodiesterase in sea urchin sperm. Biochimica et biophysica acta. 1976 Apr; 428(2):525-31. doi: 10.1016/0304-4165(76)90061-1. [PMID: 6049]
  • H TAKAHASHI, S EHARA, S USUDA, H KOBAYASHI. [On the cholinergic action of methyl N-trimethyl-gamma-amino-butyrate (Ptosin)]. [Nisshin igaku] The Japanese journal of medical progress. 1962 Oct; 49(?):677-82. doi: NULL. [PMID: 13980281]
  • M J ALLISON, M P BRYANT, I KATZ, M KEENEY. Metabolic function of branched-chain volatile fatty acids, growth factors for ruminococci. II. Biosynthesis of higher branched-chain fatty acids and aldehydes. Journal of bacteriology. 1962 May; 83(?):1084-93. doi: 10.1128/jb.83.5.1084-1093.1962. [PMID: 13860622]