Systematic characterization of chemical constituents in Mahuang decoction by UHPLC tandem linear ion trap-Orbitrap mass spectrometry coupled with feature-based molecular networking

doi:10.1002/jssc.202100121

	Systematic characterization of chemical constituents in Mahuang decoction by UHPLC tandem linear ion trap-Orbitrap mass spectrometry coupled with feature-based molecular networking
	Chen, Ling 1,2; Yao, Changliang 2; Li, Jiayuan 2; Wang, Jing 2,3; Yao, Shuai 2; Shen, Shijie 2; Yang, Lin 2; Zhang, Jianqing 2; Wei, Wenlong 2; Bi, Qirui 2
刊名	JOURNAL OF SEPARATION SCIENCE
	2021-05-29
页码	11
关键词	feature‐ based molecular networking linear ion trap‐ Orbitrap Mahuang decoction traditional Chinese medicine
ISSN号	1615-9306
DOI	10.1002/jssc.202100121
通讯作者	Guo, De-an(daguo@simm.ac.cn)
英文摘要	Comprehensive characterization of traditional Chinese medicine prescriptions has long been a hurdle due to the chemical complexity and the lack of analytical tools. Mahuang decoction is a well-known traditional Chinese medicine prescription widely used for sweating and relieving the exterior, relieving cough and asthma, but it was insufficiently chemically scrutinized. In this study, the chemical component information of Mahuang decoction was investigated by ultrahigh-performance liquid chromatography tandem linear ion trap-Orbitrap mass spectrometry. A new data processing tool, feature-based molecular networking, was introduced for grouping and elucidating the compounds. In this way, 156 chemical components were identified or tentatively characterized, including alkaloids, triterpenoid saponins, flavanone-O-glycosides, flavone-C-glycosides, and procyanidins. Thus, this research provides a solid foundation for further development of Mahuang decoction, and the adopted method is expected to be applied to other traditional Chinese medicine prescriptions.
资助项目	NationalKeyRDProgramofChina[2019YFC1711400] ; NationalKeyRDProgramofChina[2019YFC1711000] ; NationalKeyRDProgramofChina[2018YFC1707900] ; NationalNatural Science Foundation of China[82003938]
WOS关键词	SIMULTANEOUS QUANTIFICATION ; MEDICINE ; STRATEGY
WOS研究方向	Chemistry
语种	英语
出版者	WILEY-V C H VERLAG GMBH
WOS记录号	WOS:000655854300001
内容类型	期刊论文
源URL	[http://119.78.100.183/handle/2S10ELR8/297237]
专题	中国科学院上海药物研究所
通讯作者	Guo, De-an
作者单位	1.Nanjing Univ Chinese Med, Sch Pharm, Nanjing, Peoples R China 2.Chinese Acad Sci, Shanghai Inst Mat Med, Natl Engn Lab TCM Standardizat Technol, Shanghai Res Ctr Modernizat Tradit Chinese Med, Haike Rd 501, Shanghai 201203, Peoples R China 3.Guangdong Pharmaceut Univ, Sch Pharm, Guangzhou, Peoples R China
推荐引用方式 GB/T 7714	Chen, Ling,Yao, Changliang,Li, Jiayuan,et al. Systematic characterization of chemical constituents in Mahuang decoction by UHPLC tandem linear ion trap-Orbitrap mass spectrometry coupled with feature-based molecular networking[J]. JOURNAL OF SEPARATION SCIENCE,2021:11.
APA	Chen, Ling.,Yao, Changliang.,Li, Jiayuan.,Wang, Jing.,Yao, Shuai.,...&Guo, De-an.(2021).Systematic characterization of chemical constituents in Mahuang decoction by UHPLC tandem linear ion trap-Orbitrap mass spectrometry coupled with feature-based molecular networking.JOURNAL OF SEPARATION SCIENCE,11.
MLA	Chen, Ling,et al."Systematic characterization of chemical constituents in Mahuang decoction by UHPLC tandem linear ion trap-Orbitrap mass spectrometry coupled with feature-based molecular networking".JOURNAL OF SEPARATION SCIENCE (2021):11.