Butyl formate (BioDeep_00000014208)
Secondary id: BioDeep_00000623640
human metabolite
代谢物信息卡片
化学式: C5H10O2 (102.068076)
中文名称: 甲酸正丁酯
谱图信息:
最多检出来源 Macaca mulatta(otcml) 1.97%
分子结构信息
SMILES: CCCCOC=O
InChI: InChI=1S/C5H10O2/c1-2-3-4-7-5-6/h5H,2-4H2,1H3
描述信息
Butyl formate is a formate ester resulting from the formal condensation of formic acid with the hydroxy group of butan-1-ol. It has been found in apples, strawberries, sherry and Pamesan cheese, and it has a fruity, plum-like odour and taste. It has a role as a polar aprotic solvent, a flavouring agent and a fragrance. It derives from a butan-1-ol. Butyl formate, also known as butyl methanoate or fema 2916, belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group). Butyl formate has been detected, but not quantified, in blackcurrants and pineapples.
Flavouring agent. Butyl formate is found in pineapple and blackcurrant.
同义名列表
16 个代谢物同义名
Butylester kyseliny mravenci; Formic acid, butyl ester; Formic acid butyl ester; N-Butyl methanoic acid; Formate, butyl ester; Butyl methanoic acid; N-Butyl formic acid; Formate butyl ester; N-Butyl methanoate; Butyl formic acid; Butyl methanoate; N-Butyl formate; hcoo(CH2)3ch3; FEMA no. 2196; BUTYL FORMATE; FEMA 2916
数据库引用编号
12 个数据库交叉引用编号
- ChEBI: CHEBI:88514
- KEGG: C21713
- PubChem: 11614
- HMDB: HMDB0040575
- ChEMBL: CHEMBL2270394
- MetaCyc: CPD-18956
- foodb: FDB020353
- chemspider: 11125
- CAS: 592-84-7
- PMhub: MS000028848
- PubChem: 350078290
- RefMet: Butyl formate
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)
4 个相关的物种来源信息
- 1080010 - Aloe africana: 10.1021/JF010179C
- 9606 - Homo sapiens: -
- 29780 - Mangifera indica: 10.1016/0031-9422(88)80124-9
- 204187 - Plectranthus glabratus: 10.1080/10412905.1993.9698226
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
- Waseem Hassan, Senthil Narayanaperumal, Kashif Gul, Ata Ur Rahman, Antonio L Braga, Oscar E D Rodrigues, João Batista Teixeira Rocha. Modulation of diorganoyl dichalcogenides reactivity by non-bonded nitrogen interactions.
Chemico-biological interactions.
2012 Aug; 199(2):96-105. doi:
10.1016/j.cbi.2012.05.010. [PMID: 22683714] - Johnny Vlaminck, Julio López-Abán, Ana Lucía Ruano, Esther del Olmo, Antonio Muro. Vaccination against Strongyloides venezuelensis with homologue antigens using new immunomodulators.
The Journal of parasitology.
2010 Jun; 96(3):643-7. doi:
10.1645/ge-2276.1. [PMID: 20557210] - Masaya Shimizu, Yuki Muramatsu, Eiko Tada, Takeshi Kurosawa, Erika Yamaura, Hiroyuki Nakamura, Hiromichi Fujino, Yuuya Houjyo, Yuri Miyasaka, Yuuki Koide, Atsushi Nishida, Toshihiko Murayama. Effects of synthetic sphingosine-1-phosphate analogs on cytosolic phospholipase A2alpha-independent release of arachidonic acid and cell toxicity in L929 fibrosarcoma cells: the structure-activity relationship.
Journal of pharmacological sciences.
2009 Mar; 109(3):431-43. doi:
10.1254/jphs.08284fp. [PMID: 19276615] - Kristin M Skinner, Adriana Martinez-Prado, Michael R Hyman, Kenneth J Williamson, Lynda M Ciuffetti. Pathway, inhibition and regulation of methyl tertiary butyl ether oxidation in a filamentous fungus, Graphium sp.
Applied microbiology and biotechnology.
2008 Jan; 77(6):1359-65. doi:
10.1007/s00253-007-1268-2. [PMID: 18043916] - Ester Marotta, Cristina Paradisi. Positive ion chemistry of esters of carboxylic acids in air plasma at atmospheric pressure.
Journal of mass spectrometry : JMS.
2005 Dec; 40(12):1583-9. doi:
10.1002/jms.935. [PMID: 16320290] - L Suntornsuk, Th Meyer, A Lindgren, A W Frahm. A micellar electrokinetic capillary chromatography method for monitoring mycophenolic acid in serum of transplant recipients.
Die Pharmazie.
2005 Feb; 60(2):115-9. doi:
NULL. [PMID: 15739899] - T J Romano, S P Lerman, G J Thorbecke. Mechanisms by which hapten conjugates of pneumococcal polysaccharide interfere with the challenge of anti-hapten memory cells.
European journal of immunology.
1976 Jun; 6(6):434-42. doi:
10.1002/eji.1830060611. [PMID: 11101] - R D Holbert, J E Pearson, F M Gonzalez. Effect of sodium acetate infusion on renal function in the dog.
Archives internationales de pharmacodynamie et de therapie.
1976 Feb; 219(2):211-22. doi:
NULL. [PMID: 5975] - J Spencer-Peet, D C Wood, M M Glatt, S M Wiseman. Urinary d-glucaric acid excretion and serum gamma-glutamyl transpeptidase activity in alcoholism.
The British journal of addiction to alcohol and other drugs.
1975 Dec; 70(4):359-64. doi:
10.1111/j.1360-0443.1975.tb00049.x. [PMID: 2272]