Hex-trans-3-enyl butyrate (BioDeep_00000227311)

   

human metabolite


代谢物信息卡片


Hex-trans-3-enyl butyric acid

化学式: C10H18O2 (170.1307)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CCC=CCCOC(=O)CCC
InChI: InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3

描述信息

3-hexenyl butanoate is a member of the class of compounds known as fatty acid esters. Fatty acid esters are carboxylic ester derivatives of a fatty acid. 3-hexenyl butanoate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 3-hexenyl butanoate can be found in tea, which makes 3-hexenyl butanoate a potential biomarker for the consumption of this food product. 3-hexenyl butanoate may be a unique S.cerevisiae (yeast) metabolite.

同义名列表

4 个代谢物同义名

Hex-trans-3-enyl butyric acid; Hex-trans-3-enyl butyrate; 3-Hexenyl butanoic acid; hex-3-en-1-yl butanoate



数据库引用编号

6 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。

亚细胞结构定位 关联基因列表


文献列表

  • John J Beck, Glory B Merrill, Bradley S Higbee, Douglas M Light, Wai S Gee. In situ seasonal study of the volatile production of almonds (Prunus dulcis) var. 'Nonpareil' and relationship to navel orangeworm. Journal of agricultural and food chemistry. 2009 May; 57(9):3749-53. doi: 10.1021/jf9003187. [PMID: 19344182]
  • Elina Mäntylä, Giorgio A Alessio, James D Blande, Juha Heijari, Jarmo K Holopainen, Toni Laaksonen, Panu Piirtola, Tero Klemola. From plants to birds: higher avian predation rates in trees responding to insect herbivory. PloS one. 2008 Jul; 3(7):e2832. doi: 10.1371/journal.pone.0002832. [PMID: 18665271]
  • Minglin Wang, Luqin Qiao, Li Zhang, Liejun Wu, Hongxiao Tian. [Analysis of volatile constituents from leaves of plants by gas chromatography/mass spectrometry with solid-phase microextraction]. Se pu = Chinese journal of chromatography. 2006 Jul; 24(4):343-6. doi: ". [PMID: 17017156]
  • Leopold Jirovetz, David Smith, Gerhard Buchbauer. Aroma compound analysis of Eruca sativa (Brassicaceae) SPME headspace leaf samples using GC, GC-MS, and olfactometry. Journal of agricultural and food chemistry. 2002 Jul; 50(16):4643-6. doi: 10.1021/jf020129n. [PMID: 12137490]