Untargeted metabolomics coupled with chemometric analysis deducing robust markers for discrimination of processing procedures: Wine-processed Angelica sinensis as a case study

doi:10.1002/jssc.202100566

	Untargeted metabolomics coupled with chemometric analysis deducing robust markers for discrimination of processing procedures: Wine-processed Angelica sinensis as a case study
	Yin, Haoran 1,2; Ni, Hui 1,2; Zhang, Linlin 2,3; Wu, Wenyong 1,2; Wu, Xingdong 2; Zhang, Zijia 2,3; Long, Huali 2,3; Lei, Min 2,3; Hou, Jinjun 2,3; Wu, Wanying 1,2,3
刊名	JOURNAL OF SEPARATION SCIENCE
	2021-10-13
页码	19
关键词	Angelica sinensis processing procedures traditional Chinese medicine untargeted metabolomics wine-processing markers
ISSN号	1615-9306
DOI	10.1002/jssc.202100566
通讯作者	Hou, Jinjun(jinjun_hou@simm.ac.cn) ; Wu, Wanying(wanyingwu@simm.ac.cn)
英文摘要	Wine-processed Angelica Sinensis is a widely used Chinese medicinal decoction piece in China. However, there are hardly any robust markers indicating the processing procedure of wine-processed Angelica Sinensis, including the amount of rice wine and processing degree. A strategy integrating untargeted metabolomics and chemometric analysis for deducing robust markers was provided and applied to the discrimination of processing procedure. First, 86 compounds were tentatively identified in wine-processed Angelica Sinensis by ultra-high-performance liquid chromatography coupled with quadrupole-time of flight mass spectrometry. Second, 93 potential chemical markers were selected using multivariate analysis, among which nine robust chemical markers were selected by verification with commercial samples. Finally, the effects of processing temperature, time, and amount of rice wine on the three selected chemical markers were investigated through a rapid analytical method. It was demonstrated that both m/z 258.1097 and 238.1189 were positively correlated with the amount of rice wine and processing degree. In summary, this study introduced two candidate processing markers as robust markers for discriminating the processing procedures of wine-processed Angelica sinensis. It also proposed a strategy to provide the reference for the research of other decoction pieces.
资助项目	National Key R&D Program of China[2018YFC1707001] ; National Key R&D Program of China[2018YFC1707900] ; Research Project of Science and Technology Commission of Shanghai Municipality[19DZ2200400] ; National Natural Sciences Foundation of China[81973470] ; National Natural Sciences Foundation of China[81973455] ; National Science and Technology Major Project[2019ZX09201004-003-042]
WOS关键词	RADIX ; TIME ; RATS
WOS研究方向	Chemistry
语种	英语
出版者	WILEY-V C H VERLAG GMBH
WOS记录号	WOS:000707868400001
内容类型	期刊论文
源URL	[http://119.78.100.183/handle/2S10ELR8/298475]
专题	中国科学院上海药物研究所
通讯作者	Hou, Jinjun; Wu, Wanying
作者单位	1.Nanjing Univ Chinese Med, Sch Chinese Mat Med, Nanjing, Peoples R China 2.Chinese Acad Sci, Shanghai Res Ctr Modernizat Tradit Chinese Med, Shanghai Inst Mat Med, Natl Engn Lab TCM Standardizat Technol, Shanghai, Peoples R China 3.Univ Chinese Acad Sci, Beijing, Peoples R China
推荐引用方式 GB/T 7714	Yin, Haoran,Ni, Hui,Zhang, Linlin,et al. Untargeted metabolomics coupled with chemometric analysis deducing robust markers for discrimination of processing procedures: Wine-processed Angelica sinensis as a case study[J]. JOURNAL OF SEPARATION SCIENCE,2021:19.
APA	Yin, Haoran.,Ni, Hui.,Zhang, Linlin.,Wu, Wenyong.,Wu, Xingdong.,...&Wu, Wanying.(2021).Untargeted metabolomics coupled with chemometric analysis deducing robust markers for discrimination of processing procedures: Wine-processed Angelica sinensis as a case study.JOURNAL OF SEPARATION SCIENCE,19.
MLA	Yin, Haoran,et al."Untargeted metabolomics coupled with chemometric analysis deducing robust markers for discrimination of processing procedures: Wine-processed Angelica sinensis as a case study".JOURNAL OF SEPARATION SCIENCE (2021):19.