Methyl propenyl ketone (BioDeep_00000020767)

 

Secondary id: BioDeep_00000405421, BioDeep_00000604121

human metabolite Endogenous


代谢物信息卡片


3-Penten-2-one (methyl vinyl ketone)

化学式: C5H8O (84.0575118)
中文名称: 3-戊烯-2-酮
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C/C=C/C(=O)C
InChI: InChI=1S/C5H8O/c1-3-4-5(2)6/h3-4H,1-2H3

描述信息

Methyl propenyl ketone, also known as (3E)-3-penten-2-one or 2-oxo-3-pentene, belongs to the class of organic compounds known as enones. Enones are compounds containing the enone functional group, with the structure RC(=O)CR. Thus, methyl propenyl ketone is considered to be an oxygenated hydrocarbon lipid molecule. Methyl propenyl ketone is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Methyl propenyl ketone, with regard to humans, has been found to be associated with several diseases such as nonalcoholic fatty liver disease and ulcerative colitis. Methyl propenyl ketone has also been linked to the inborn metabolic disorder celiac disease. Methyl propenyl ketone is occasionally found as a volatile component of normal human biofluids. It is found as a volatile in the hawthorn fruit upon ripening, and also is part of the scent components of the urine of some animals. Methyl propenyl ketone is a volatile organic compound.

同义名列表

17 个代谢物同义名

3-Penten-2-one (methyl vinyl ketone); Methyl 1-propenyl ketone; Methyl propenyl ketone; (3E)-Pent-3-en-2-one; trans-3-Penten-2-one; (3E)-3-Penten-2-one; (e)-Pent-3-en-2-one; (e)-3-Penten-2-one; Ethylidene acetone; 2-oxo-(3E)-Pentene; (3E)-Penten-2-one; 2-oxo-3-Pentene; pent-3-en-2-one; 3-Penten-2-one; FEMA no. 3417; 3-Penten-2-one; 3-Penten-2-one



数据库引用编号

14 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)

3 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

  • Eva Crosas, Sergio Porté, Agrin Moeini, Jaume Farrés, Josep A Biosca, Xavier Parés, M Rosario Fernández. Novel alkenal/one reductase activity of yeast NADPH:quinone reductase Zta1p. Prospect of the functional role for the ζ-crystallin family. Chemico-biological interactions. 2011 May; 191(1-3):32-7. doi: 10.1016/j.cbi.2011.01.021. [PMID: 21276778]
  • Joanna Rudnicka, Paweł Mochalski, Agapios Agapiou, Milt Statheropoulos, Anton Amann, Bogusław Buszewski. Application of ion mobility spectrometry for the detection of human urine. Analytical and bioanalytical chemistry. 2010 Nov; 398(5):2031-8. doi: 10.1007/s00216-010-4147-0. [PMID: 20820995]
  • Valerie Walker, Graham A Mills, Elizabeth M Stansbridge. 3-Penten-2-one, a novel aldehyde adduct, is a biomarker for increased acetaldehyde in urine. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2009 Mar; 877(8-9):784-90. doi: 10.1016/j.jchromb.2009.02.017. [PMID: 19246253]
  • Jae Kwak, Alan Willse, Koichi Matsumura, Maryanne Curran Opiekun, Weiguang Yi, George Preti, Kunio Yamazaki, Gary K Beauchamp. Genetically-based olfactory signatures persist despite dietary variation. PloS one. 2008; 3(10):e3591. doi: 10.1371/journal.pone.0003591. [PMID: 18974891]
  • Frank Röck, Sven Mueller, Udo Weimar, Hans-Georg Rammensee, Peter Overath. Comparative analysis of volatile constituents from mice and their urine. Journal of chemical ecology. 2006 Jun; 32(6):1333-46. doi: 10.1007/s10886-006-9091-2. [PMID: 16770722]