2-Methyl-2-butanol (BioDeep_00000014014)

 

Secondary id: BioDeep_00000618684, BioDeep_00001867744

human metabolite natural product


代谢物信息卡片


2-Methyl-2-butanol (tert-amyl alcohol)

化学式: C5H12O (88.0888102)
中文名称: 叔戊醇
谱图信息: 最多检出来源 Mus musculus(blood) 50%

分子结构信息

SMILES: CCC(C)(C)O
InChI: InChI=1S/C5H12O/c1-4-5(2,3)6/h6H,4H2,1-3H3

描述信息

2-Methyl-2-butanol, also known as t-amyl alcohol (TAA) or amylene hydrate, belongs to the class of organic compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H). 2-Methyl-2-butanol is a pungent tasting compound. 2-methyl-2-butanol has been detected, but not quantified, in several different foods, such as red bell peppers, pepper (c. annuum), fruits, yellow bell peppers, and orange bell peppers. This could make 2-methyl-2-butanol a potential biomarker for the consumption of these foods. In 1930s TAA was mainly used as a solvent for tribromoethanol (TBE), forming Avertin at a 0.5:1 volume ratio of TAA to TBE. When ingested, the effects of TAA may begin in about 30 minutes and can last up to 2 days. The oral LD50 in rats is 1 g/kg.
Isolated from strawberry aroma. 2-Methyl-2-butanol is found in many foods, some of which are red bell pepper, fruits, yellow bell pepper, and orange bell pepper.

同义名列表

31 个代谢物同义名

2-Methyl-2-butanol (tert-amyl alcohol); Amylalkohol, tertiaerer; Dimethyl ethyl carbinol; Ethyl dimethyl carbinol; 1,1-Dimethyl-1-propanol; Dimethylethylcarbinol; Ethyldimethylcarbinol; Amylene hydrate, usan; Tert-isoamyl alcohol; 3-Methyl-butanol-(3); Amylene hydrate (NF); Amylene hydric acid; Tert-pentyl alcohol; Tert-N-amyl alcohol; Potassium t-amylate; 2-Methylbutan-2-ol; 3-Methylbutan-3-ol; 2-Methyl butanol-2; 2-METHYL-2-BUTANOL; Methyl-3 butanol-3; Methyl-2 butanol-2; 2-BUTANOL,2-methyl; tert-Amyl Alcohol; Amylenum hydratum; t-Pentyl alcohol; Amylene hydrate; t-Amyl alcohol; Methyl butanol; Tert-pentanol; C2H5C(CH3)2oh; 2m2b



数据库引用编号

15 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)

14 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

  • Diem-Kieu Nguyen, Tri-Phuong Nguyen, Yi-Rong Li, Masaru Ohme-Takagi, Zin-Huang Liu, Thach-Thao Ly, Van-Anh Nguyen, Ngoc-Nam Trinh, Hao-Jen Huang. Comparative study of two indoor microbial volatile pollutants, 2-Methyl-1-butanol and 3-Methyl-1-butanol, on growth and antioxidant system of rice (Oryza sativa) seedlings. Ecotoxicology and environmental safety. 2024 Mar; 272(?):116055. doi: 10.1016/j.ecoenv.2024.116055. [PMID: 38340597]
  • Sarathadevi Rajendran, Patrick Silcock, Phil Bremer. Volatile Organic Compounds (VOCs) Produced by Levilactobacillus brevis WLP672 Fermentation in Defined Media Supplemented with Different Amino Acids. Molecules (Basel, Switzerland). 2024 Feb; 29(4):. doi: 10.3390/molecules29040753. [PMID: 38398505]
  • Tu-Trinh Thi Truong, Chi-Chou Chiu, Pei-Yu Su, Jing-Yu Chen, Tri-Phuong Nguyen, Masaru Ohme-Takagi, Ruey-Hua Lee, Wan-Hsing Cheng, Hao-Jen Huang. Signaling pathways involved in microbial indoor air pollutant 3-methyl-1-butanol in the induction of stomatal closure in Arabidopsis. Environmental science and pollution research international. 2024 Jan; 31(5):7556-7568. doi: 10.1007/s11356-023-31641-y. [PMID: 38165546]
  • Mikael A Molander, Inis B Winde, Joseph Burman, Franklin N Nyabuga, Tobias U T Lindblom, Lawrence M Hanks, Jocelyn G Millar, Mattias C Larsson. Common Cerambycid Pheromone Components as Attractants for Longhorn Beetles (Cerambycidae) Breeding in Ephemeral Oak Substrates in Northern Europe. Journal of chemical ecology. 2019 Jul; 45(7):537-548. doi: 10.1007/s10886-019-01082-4. [PMID: 31254146]
  • Xiang Ma, Erpei Wang, Yuyun Lu, Yong Wang, Shiyi Ou, Rian Yan. Acylation of Antioxidant of Bamboo Leaves with Fatty Acids by Lipase and the Acylated Derivatives' Efficiency in the Inhibition of Acrylamide Formation in Fried Potato Crisps. PloS one. 2015; 10(6):e0130680. doi: 10.1371/journal.pone.0130680. [PMID: 26098744]
  • Jacek Sein Anand, Joanna Gieroń, Wojciech Lechowicz, Daria Schetz, Maria Kała, Wojciech Waldman. Acute intoxication due to tert-amyl alcohol--a case report. Forensic science international. 2014 Sep; 242(?):e31-e33. doi: 10.1016/j.forsciint.2014.07.020. [PMID: 25112153]
  • Sonia Moreno-Perez, Marco Filice, Jose M Guisan, Gloria Fernandez-Lorente. Synthesis of ascorbyl oleate by transesterification of olive oil with ascorbic acid in polar organic media catalyzed by immobilized lipases. Chemistry and physics of lipids. 2013 Sep; 174(?):48-54. doi: 10.1016/j.chemphyslip.2013.06.003. [PMID: 23891831]
  • Xiang Ma, Rian Yan, Shuqi Yu, Yuyun Lu, Zhuo Li, Haohao Lu. Enzymatic acylation of isoorientin and isovitexin from bamboo-leaf extracts with fatty acids and antiradical activity of the acylated derivatives. Journal of agricultural and food chemistry. 2012 Oct; 60(43):10844-9. doi: 10.1021/jf303595e. [PMID: 23057589]
  • Qisi Zhu, Tie Li, Yonghua Wang, Bo Yang, Yongjun Ma. A two-stage enzymatic process for synthesis of extremely pure high oleic glycerol monooleate. Enzyme and microbial technology. 2011 Feb; 48(2):143-7. doi: 10.1016/j.enzmictec.2010.10.009. [PMID: 22112823]
  • Carissa Ritner, Harold S Bernstein. Fate mapping of human embryonic stem cells by teratoma formation. Journal of visualized experiments : JoVE. 2010 Aug; ?(42):. doi: 10.3791/2036. [PMID: 20729802]
  • David L Morris, Kae Won Cho, Yingjiang Zhou, Liangyou Rui. SH2B1 enhances insulin sensitivity by both stimulating the insulin receptor and inhibiting tyrosine dephosphorylation of insulin receptor substrate proteins. Diabetes. 2009 Sep; 58(9):2039-47. doi: 10.2337/db08-1388. [PMID: 19542202]
  • Sinikka Vainiotalo, Vesa Riihimäki, Kaija Pekari, Eija Teräväinen, Antero Aitio. Toxicokinetics of methyl tert-butyl ether (MTBE) and tert-amyl methyl ether (TAME) in humans, and implications to their biological monitoring. Journal of occupational and environmental hygiene. 2007 Oct; 4(10):739-50. doi: 10.1080/15459620701551540. [PMID: 17668360]
  • Sinikka Vainiotalo, Leea Kuusimäki, Kaija Pekari. Exposure to MTBE, TAME and aromatic hydrocarbons during gasoline pump maintenance, repair and inspection. Journal of occupational health. 2006 Sep; 48(5):347-57. doi: 10.1539/joh.48.347. [PMID: 17053301]
  • Susan C J Sumner, Derek B Janszen, Bahman Asgharian, Timothy A Moore, Horace D Parkinson, Timothy R Fennell. Species and gender differences in the metabolism and distribution of tertiary amyl methyl ether in male and female rats and mice after inhalation exposure or gavage administration. Journal of applied toxicology : JAT. 2003 Nov; 23(6):427-36. doi: 10.1002/jat.931. [PMID: 14635267]
  • W Dekant, U Bernauer, E Rosner, A Amberg. Biotransformation of MTBE, ETBE, and TAME after inhalation or ingestion in rats and humans. Research report (Health Effects Institute). 2001 May; ?(102):29-71; discussion 95. doi: NULL. [PMID: 11504147]
  • A Amberg, U Bernauer, D Scheutzow, W Dekant. Biotransformation of [(12)C]- and [(13)C]-tert-amyl methyl ether and tert-amyl alcohol. Chemical research in toxicology. 1999 Oct; 12(10):958-64. doi: 10.1021/tx990078x. [PMID: 10525272]
  • A S Collins, S C Sumner, S J Borghoff, M A Medinsky. A physiological model for tert-amyl methyl ether and tert-amyl alcohol: hypothesis testing of model structures. Toxicological sciences : an official journal of the Society of Toxicology. 1999 May; 49(1):15-28. doi: 10.1093/toxsci/49.1.15. [PMID: 10367338]