Methyl isobutyl ketone (BioDeep_00000004247)

 

Secondary id: BioDeep_00000405545, BioDeep_00000865912

human metabolite Endogenous Volatile Flavor Compounds natural product


代谢物信息卡片


2-Methylpropyl methyl ketone

化学式: C6H12O (100.0888102)
中文名称: 甲基异丁基甲酮, 甲基异丁基酮
谱图信息: 最多检出来源 Homo sapiens(feces) 99.5%

分子结构信息

SMILES: CC(=O)CC(C)C
InChI: InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3

描述信息

Methyl isobutyl ketone (MIBK) is an organic solvent. MIBK is among the top ten most popular organic solvents used in industry. MIBK is occasionally found as a volatile component of urine. MIBK in urine is considered as a biological marker of occupational exposure to this solvent. Olfactory perception is significant but adaptation may occur. The typical toxicity effects of MIBK in humans exposed at 50 to 100 ppm are mucous membrane irritation and weak effects on the central nervous system (CNS) such as headache. Visual dysfunction has been reported in workers exposed to a mixture of organic solvents containing MIBK. Memory impairment was detected in clinical observation on a 44-year-old man who had been exposed to MIBK at 100 ppm for more than 10 years. Regarding to the route of absorption, skin penetration of MIBK is substantial. (PMID: 12592578, 17485256, 16464817, 5556886).
Present in orange, lemon, concord grape, vinegar, cheeses, cooked beef, roasted peanut and other foodstuffs. Flavouring ingredient

同义名列表

28 个代谢物同义名

2-Methylpropyl methyl ketone; Ethyl iso-butyl ketone; Methyl-isobutyl-cetone; Methyl isobutyl ketone; Isobutyl methyl ketone; Methyl I-butyl ketone; 4-Methyl-2-oxopentane; Metyloizobutyloketon; 2-Methyl-4-pentanone; 4-Methyl-2-pentanone; 4-Methylpentan-2-one; 4-Methyl-pentan-2-ON; Isobutyl-methylketon; Metilisobutilchetone; 4-Methyl-2-pentanon; Methylisobutylketon; 4-Metilpentan-2-one; 2-Methyl-4-pentanal; Methylpentan-2-one; Isopropyl acetone; Isopropylacetone; Isohexanone; Shell mibk; Hexanone; Hexone; Hexon; Methyl isobutyl ketone; Methyl isobutyl ketone



数据库引用编号

17 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)

29 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

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