Isoamyl butyrate (BioDeep_00000023797)

 

Secondary id: BioDeep_00000623368, BioDeep_00000869526

human metabolite Endogenous


代谢物信息卡片


Butanoic acid, 3-methylbutyl ester

化学式: C9H18O2 (158.1306728)
中文名称: 丁酸异戊酯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CCCC(=O)OCCC(C)C
InChI: InChI=1S/C9H18O2/c1-4-5-9(10)11-7-6-8(2)3/h8H,4-7H2,1-3H3

描述信息

Isoamyl butyrate, also known as isopentyl butanoate, is the butanoate ester of isoamylol. It derives from an isoamylol. Isoamyl butyrate belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. Isoamyl butyrate is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Isoamyl butyrate is a potentially toxic compound. It has a role as a metabolite.
Present in fruit aromas, e.g. apricot, melon, mango etcand is) also present in wines, eucalyptus oil and coconut oil. It is used in fruit flavours. Isoamyl butyrate is found in many foods, some of which are fats and oils, fruits, apple, and roman camomile.

同义名列表

22 个代谢物同义名

Butanoic acid, 3-methylbutyl ester; Butyric acid, isopentyl ester; Butyric acid isopentyl ester; Isopentyl alcohol, butyrate; 3-Methylbutyl butyric acid; 3-Methyl-1-butyl butanoate; Butyric acid isoamylester; Butyrate isopentyl ester; Isopentyl butanoic acid; 3-Methylbutyl butanoate; Isopentyl butyric acid; 3-Methylbutyl butyrate; Isoamyl butanoic acid; Isoamyl butyric acid; Isopentyl-N-butyrate; Isopentyl butanoate; Isoamyl-N-butyrate; Isoamyl N-butyrate; Isopentyl butyrate; Isoamyl butanoate; Isoamyl butyrate; Isoamyl butylate



数据库引用编号

9 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)

6 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

  • Chia-Chuan Chang, Angela Fay Ku, Yun-Yu Tseng, Wen-Bin Yang, Jim-Min Fang, Chi-Huey Wong. 6,8-Di-C-glycosyl flavonoids from Dendrobium huoshanense. Journal of natural products. 2010 Feb; 73(2):229-32. doi: 10.1021/np900252f. [PMID: 20055483]
  • Jorge Toledo, Edi A Malo, Leopoldo Cruz-López, Julio C Rojas. Field evaluation of potential fruit-derived lures for Anastrepha obliqua (Diptera: Tephritidae). Journal of economic entomology. 2009 Dec; 102(6):2072-7. doi: 10.1603/029.102.0608. [PMID: 20069833]
  • Leopoldo Cruz-López, Edi A Malo, Jorge Toledo, Armando Virgen, Alejandro Del Mazo, Julio C Rojas. A new potential attractant for Anastrepha obliqua from Spondias mombin fruits. Journal of chemical ecology. 2006 Feb; 32(2):351-65. doi: 10.1007/s10886-005-9006-7. [PMID: 16555133]