Acetic anhydride (BioDeep_00000020601)

   

human metabolite Endogenous


代谢物信息卡片


Acetic anhydride, 3H-labeled

化学式: C4H6O3 (102.0316926)
中文名称: 乙酸酐
谱图信息: 最多检出来源 Homo sapiens(feces) 99.71%

分子结构信息

SMILES: CC(=O)OC(=O)C
InChI: InChI=1S/C4H6O3/c1-3(5)7-4(2)6/h1-2H3

描述信息

Acetic anhydride is an esterification agent for use in prepn. of modified food starch and for acetylation of monoglycerides Acetic anhydride is a versatile reagent for acetylations, the introduction of acetyl groups to organic substrates. In these conversions, acetic anhydride is viewed as a source of CH3CO+. Alcohols and amines are readily acetylated. For example, the reaction of acetic anhydride with ethanol yields ethyl acetate: (CH3CO)2O + CH3CH2OH → CH3CO2CH2CH3 + CH3COOH. Acetic anhydride is an irritant and flammable. Because of its reactivity toward water, alcohol foam or carbon dioxide are preferred for fire suppression. The vapour of acetic anhydride is harmful. Acetic anhydride is the chemical compound with the formula (CH3CO)2O. Commonly abbreviated Ac2O, it is one of the simplest acid anhydrides and is a widely used reagent in organic synthesis. It is a colorless liquid that smells strongly of acetic acid, which is formed by its reaction with the moisture in the air. As indicated by its organic chemistry, Ac2O is mainly used for acetylations leading to commercially significant materials. Its largest application is for the conversion of cellulose to cellulose acetate, which is a component of photographic film and other coated materials. Similarly it is used in the production of aspirin, acetyl salicylic acid, which is prepared by the acetylation of salicylic acid. It is also used as a wood preservative via autoclave impregnation to make a longer lasting timber. Because of its use for the synthesis of heroin by the diacetylation of morphine, acetic anhydride (known as AA in clandestine chemistry circles) is listed as a U.S. DEA List II Precursor, and restricted in many other countries. The largest markets for diverted acetic anhydride continue to be heroin laboratories in Afghanistan

同义名列表

25 个代谢物同义名

Acetic anhydride, 3H-labeled; Anhydrid kyseliny octove; Acetyltrimethyl-silane; Ethanoic anhydric acid; Acetic acid, anhydride; Acetic acid anhydride; Essigsaeureanhydrid; Ethanoic anhydrate; Azijnzuuranhydride; Anhydride acetique; Ethanoic anhydride; Acetyl acetic acid; Acetate anhydride; Octowy bezwodnik; ACETIC ANHYDRIDE; Anidride acetica; Acetyl anhydride; Acetyl acetate; Acetanhydride; Acetyl oxide; Acetic oxide; Acetyl ether; (CH3CO)2O; (MeCO)2O; Ac2O



数据库引用编号

11 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)

2 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

  • Xingli Huo, Huijun Liu, Shengjie Wang, Shanmei Yin, Zongning Yin. The inhibitory effect and mechanism of small molecules on acetic anhydride-induced BSA acetylation and aggregation. Colloids and surfaces. B, Biointerfaces. 2023 Mar; 225(?):113265. doi: 10.1016/j.colsurfb.2023.113265. [PMID: 36931043]
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  • Josiane Bartz, Jorge Tiago Goebel, Marcos Antônio Giovanaz, Elessandra da Rosa Zavareze, Manoel Artigas Schirmer, Alvaro Renato Guerra Dias. Acetylation of barnyardgrass starch with acetic anhydride under iodine catalysis. Food chemistry. 2015 Jul; 178(?):236-42. doi: 10.1016/j.foodchem.2015.01.095. [PMID: 25704707]
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