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酒炙当归和川芎的化学变化:气相色谱-三重四极杆质谱联用的化学特征图谱和标志物选择。

Chemical changes of Angelicae Sinensis Radix and Chuanxiong Rhizoma by wine treatment: chemical profiling and marker selection by gas chromatography coupled with triple quadrupole mass spectrometry.

机构信息

Division of Life Science and Center for Chinese Medicine, The Hong Kong University of Science and Technology, Hong Kong SAR, China.

出版信息

Chin Med. 2013 Jun 6;8(1):12. doi: 10.1186/1749-8546-8-12.

Abstract

BACKGROUND

Angelicae Sinensis Radix (ASR) and Chuanxiong Rhizoma (CR) can be treated with wine to promote their biological functions in Chinese medicine. Both ASR and CR contain similar volatile chemicals that could be altered after wine treatment. This study aims to identify the differential chemical profiles and to select marker chemicals of ASR and CR before and after wine treatment.

METHODS

Chemical analyses were carried out by gas chromatography-triple quadrupole mass spectrometry (GC-QQQ-MS/MS) coupled with multivariate statistical analysis. Characterization of the compositions of essential oils was performed by automated matching to the MS library and comparisons of their mass spectra (NIST08 database). For ferulic acid, butylphthalide, Z-butylidenephthalide, senkyunolide A and Z-ligustilide, the mass spectrometer was operated in electron ionization mode, the selection reaction monitoring mode was used and an evaluation of the stability and sensitivity of the chromatographic system was performed for the tested extraction.

RESULTS

Principal component analysis (PCA) simultaneously distinguished ASR and CR from different forms. Ferulic acid, Z-butylidenephthalide, Z-ligustilide, butylphthalide and senkyunolide A were screened by PCA loading plots and can be used as chemical markers for discrimination among different groups of samples.

CONCLUSION

Different chemical profiles of ASR and CR after wine treatment could be identified by GC-QQQ-MS/MS. The five marker chemicals selected by PCA, namely ferulic acid, butylphthalide, Z-butylidenephthalide, senkyunolide A and Z-ligustilide, were sufficient to distinguish between the crude and corresponding wine-treated forms of ASR and CR.

摘要

背景

当归和川芎可以用酒来炮制以增强其在中医药中的生物功能。当归和川芎都含有类似的挥发性化学物质,这些物质在酒炮制后可能会发生变化。本研究旨在鉴定炮制前后当归和川芎的差异化学特征,并选择其标记性化学成分。

方法

采用气相色谱-三重四极杆质谱联用(GC-QQQ-MS/MS)结合多元统计分析的方法进行化学分析。通过自动匹配 MS 库和比较其质谱(NIST08 数据库)对精油成分进行特征描述。对于阿魏酸、丁基苯酞、Z-丁烯基邻苯二甲酸、川芎嗪 A 和 Z-藁本内酯,质谱仪采用电子电离模式,选择反应监测模式,并对测试提取的色谱系统的稳定性和灵敏度进行评估。

结果

主成分分析(PCA)同时将当归和川芎从不同形式中区分出来。通过 PCA 载荷图筛选出阿魏酸、Z-丁烯基邻苯二甲酸、Z-藁本内酯、丁基苯酞和川芎嗪 A,可以作为不同组别样品之间区分的化学标记物。

结论

GC-QQQ-MS/MS 可鉴定出当归和川芎酒炮制后的不同化学特征。通过 PCA 选择的 5 种标记性化学成分,即阿魏酸、丁基苯酞、Z-丁烯基邻苯二甲酸、川芎嗪 A 和 Z-藁本内酯,足以区分当归和川芎的生品和相应的酒制品。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/e084/3693868/e8ce79eff488/1749-8546-8-12-1.jpg

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