tert-Butyl acetate (BioDeep_00000663361)
代谢物信息卡片
化学式: C6H12O2 (116.0837)
中文名称: 乙酸叔丁酯, 醋酸特丁酯
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CC(=O)OC(C)(C)C
InChI: InChI=1S/C6H12O2/c1-5(7)8-6(2,3)4/h1-4H3
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)
0 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 |
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文献列表
- James S Bus, Marcy I Banton, Willem D Faber, Christopher R Kirman, Douglas B McGregor, Daniel B Pourreau. Human health screening level risk assessments of tertiary-butyl acetate (TBAC): calculated acute and chronic reference concentration (RfC) and Hazard Quotient (HQ) values based on toxicity and exposure scenario evaluations.
Critical reviews in toxicology.
2015 Feb; 45(2):142-71. doi:
10.3109/10408444.2014.980884
. [PMID: 25629921] - Willem Faber, Daniel Kirkpatrick, Pragati Coder, Abby Li, Susan Borghoff, Marcy Banton. Subchronic, reproductive, and maternal toxicity studies with tertiary butyl acetate (TBAC).
Regulatory toxicology and pharmacology : RTP.
2014 Apr; 68(3):332-42. doi:
10.1016/j.yrtph.2014.01.006
. [PMID: 24486531] - John D Budroe, Joseph P Brown, Andrew G Salmon, Andrew G Salsmon, Melanie A Marty. Acute toxicity and cancer risk assessment values for tert-butyl acetate.
Regulatory toxicology and pharmacology : RTP.
2004 Oct; 40(2):168-76. doi:
10.1016/j.yrtph.2004.07.001
. [PMID: 15450719] - Eva González-García, Virgil Helaine, Gérard Klein, Melanie Schuermann, Georg A Sprenger, Wolf-Dieter Fessner, Jean-Louis Reymond. Fluorogenic stereochemical probes for transaldolases.
Chemistry (Weinheim an der Bergstrasse, Germany).
2003 Feb; 9(4):893-9. doi:
10.1002/chem.200390110
. [PMID: 12584704] - A-M Riquet, D Scholler, A Feigenbaum. Tailoring fatty food simulants made from solvent mixtures (2): determining the equivalent migration behaviour of olive oil and of solvents in the case of polyolefins.
Food additives and contaminants.
2002 Jun; 19(6):582-93. doi:
10.1080/02652030110105194
. [PMID: 12042025] - H Toshima, H Aramaki, A Ichihara. Syntheses of stereochemically restricted lactone-type analogues of jasmonic acids.
Bioscience, biotechnology, and biochemistry.
2000 Sep; 64(9):1988-92. doi:
10.1271/bbb.64.1988
. [PMID: 11055410]