Isovaleraldehyde (BioDeep_00000004238)

 

Secondary id: BioDeep_00000405606, BioDeep_00000861471

human metabolite blood metabolite


代谢物信息卡片


3-Methyl-butyraldehyde

化学式: C5H10O (86.07316100000001)
中文名称: 异戊醛
谱图信息: 最多检出来源 Homo sapiens(blood) 6.05%

分子结构信息

SMILES: C(CC=O)(C)C
InChI: InChI=1S/C5H10O/c1-5(2)3-4-6/h4-5H,3H2,1-2H3

描述信息

Iso-Valeraldehyde, also known as isoamyl aldehyde or 3-methyl-butanal, belongs to the class of organic compounds known as alpha-hydrogen aldehydes. These are aldehydes with the general formula HC(H)(R)C(=O)H, where R is an organyl group. Iso-Valeraldehyde exists in all eukaryotes, ranging from yeast to humans. Iso-Valeraldehyde is an aldehydic, chocolate, and ethereal tasting compound. Iso-Valeraldehyde is found, on average, in the highest concentration within a few different foods, such as milk (cow), beers, and taco and in a lower concentration in kohlrabis, corns, and tortilla. Iso-Valeraldehyde has also been detected, but not quantified, in several different foods, such as muskmelons, highbush blueberries, fenugreeks, hazelnuts, and dills. This could make iso-valeraldehyde a potential biomarker for the consumption of these foods. A methylbutanal that is butanal substituted by a methyl group at position 3. Iso-Valeraldehyde, with regard to humans, has been found to be associated with several diseases such as ulcerative colitis, crohns disease, perillyl alcohol administration for cancer treatment, and hepatic encephalopathy; iso-valeraldehyde has also been linked to the inborn metabolic disorder celiac disease.
Occurs in orange, bergamot, lemon, sandalwood, citronella, peppermint, eucalyptus and other oilsand is also in apple, grape, peach cider, vinegar, wines, wheatbreads, scallops and ginger

同义名列表

21 个代谢物同义名

3-Methyl-butyraldehyde; 3-Methylbutyraldehyde; Isovaleric aldehyde; Isovalerylaldehyde; 3-Methyl-1-butanal; 3-Methylbutan-1-al; beta-Methylbutanal; 2-Methylbutanal-4; iso-Valeraldehyde; Isovaleraldehyde; 3-Methyl-butanal; Isoamyl aldehyde; Β-methylbutanal; Isopentaldehyde; 3-Methylbutanal; Isoamylaldehyde; b-Methylbutanal; Methyl butanal; Iso-C4H9CHO; Isopentanal; Isovaleral



数据库引用编号

16 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome(0)

BioCyc(1)

PlantCyc(0)

代谢反应

9 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(8)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(1)

PharmGKB(0)

51 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

  • Yu Shimada, Motofumi Kumazoe, Yushi Otsuka, Rin Tetsuzen, Yoshinori Fujimura, Hirofumi Tachibana. Neuroprotective effect of isovaleraldehyde accompanied with upregulation of BDNF and CREB phosphorylation via the PKA pathway. Journal of natural medicines. 2024 Jan; 78(1):208-215. doi: 10.1007/s11418-023-01763-1. [PMID: 38063995]
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  • Tsuyoshi Yoda, Yudai Yamada, Yukiyasu Chounan. Effects of isovaleraldehyde on cell-sized lipid bilayer vesicles. Biophysical chemistry. 2021 12; 279(?):106698. doi: 10.1016/j.bpc.2021.106698. [PMID: 34644672]
  • Ping Yang, Huanlu Song, Yanping Lin, Tianyang Guo, Lijin Wang, Michael Granvogl, Yongquan Xu. Differences of characteristic aroma compounds in Rougui tea leaves with different roasting temperatures analyzed by switchable GC-O-MS and GC × GC-O-MS and sensory evaluation. Food & function. 2021 Jun; 12(11):4797-4807. doi: 10.1039/d1fo00165e. [PMID: 33861271]
  • Virgilio Giannone, Mariagrazia Giarnetti, Alfio Spina, Aldo Todaro, Biagio Pecorino, Carmine Summo, Francesco Caponio, Vito Michele Paradiso, Antonella Pasqualone. Physico-chemical properties and sensory profile of durum wheat Dittaino PDO (Protected Designation of Origin) bread and quality of re-milled semolina used for its production. Food chemistry. 2018 Feb; 241(?):242-249. doi: 10.1016/j.foodchem.2017.08.096. [PMID: 28958525]
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  • Mar Roldán, Jorge Ruiz, José Sánchez Del Pulgar, Trinidad Pérez-Palacios, Teresa Antequera. Volatile compound profile of sous-vide cooked lamb loins at different temperature-time combinations. Meat science. 2015 Feb; 100(?):52-57. doi: 10.1016/j.meatsci.2014.09.010. [PMID: 25306511]
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  • Ronan Corcuff, Julien Mercier, Russell Tweddell, Joseph Arul. Effect of water activity on the production of volatile organic compounds by Muscodor albus and their effect on three pathogens in stored potato. Fungal biology. 2011 Mar; 115(3):220-7. doi: 10.1016/j.funbio.2010.12.005. [PMID: 21354528]
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  • Yang-Qing He, Zhan-Ying Ma, Xiao-Mei Wei, Bao-Zhong Du, Zhan-Xin Jing, Bing-Hua Yao, Li-Ming Gao. Chemical constituents from Delphinium chrysotrichum and their biological activity. Fitoterapia. 2010 Oct; 81(7):929-31. doi: 10.1016/j.fitote.2010.06.008. [PMID: 20550959]
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  • Anthony Schilmiller, Feng Shi, Jeongwoon Kim, Amanda L Charbonneau, Daniel Holmes, A Daniel Jones, Robert L Last. Mass spectrometry screening reveals widespread diversity in trichome specialized metabolites of tomato chromosomal substitution lines. The Plant journal : for cell and molecular biology. 2010 May; 62(3):391-403. doi: 10.1111/j.1365-313x.2010.04154.x. [PMID: 20113441]
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