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基于超高效液相色谱/四极杆飞行时间质谱代谢组学方法鉴别郁金的不同品种

Discriminating from species of Curcumae Radix (Yujin) by a UHPLC/Q-TOFMS-based metabolomics approach.

作者信息

Liu Fang, Bai Xu, Yang Feng-Qing, Zhang Xiao-Jing, Hu Yuanjia, Li Peng, Wan Jian-Bo

机构信息

State Key Laboratory of Quality Research in Chinese Medicine, Institute of Chinese Medical Sciences, University of Macau, Macao, People's Republic of China.

Waters Technologies (Shanghai) Ltd., Shanghai, People's Republic of China.

出版信息

Chin Med. 2016 Apr 29;11:21. doi: 10.1186/s13020-016-0095-8. eCollection 2016.

Abstract

BACKGROUND

Chinese medicinal herbs may use more than one species of Curcumae Radix (Yujin) is the tuberous roots of Curcumae wenyujin, C. kwangsiensis, C. phaeocaulis and C. longa. This study aimed to characterize the chemical profiles of these different species of Curcumae Radix, and develop a method for rapid discrimination of these species by ultra-high performance liquid chromatography-quadrupole time-of-flight mass spectrometry (UHPLC/Q-TOFMS) combined with multivariate statistical analysis.

METHODS

The metabolomes of 33 different batches of Curcumae Radix derived from four Curcumae species were profiled by UHPLC/Q-TOFMS. The resulting sample codes, t R-m/z pairs and ion intensities were processed by unsupervised principal component analysis (PCA) and supervised orthogonal partial least squared discriminant analysis (OPLS-DA) to characterize the chemical composition of Curcumae Radix across the four different species.

RESULTS

Obvious differences were observed in the chemical compositions of the Curcumae Radix samples derived from the four different species according to PCA and OPLS-DA. These results suggested that curcumin, curcumenone, curcumenol and zederone could be used as unique chemical markers for C. longa, C. wenyujin, C. phaeocaulis and C. kwangsiensis, respectively.

CONCLUSIONS

This study developed a UHPLC/Q-TOFMS method coupled with multivariate statistical analysis to discriminate between Curcumae Radix samples from four different Curcumae species, i.e., C. longa, C. wenyujin, C. phaeocaulis and C. kwangsiensis. Notably, this new approach resulted in the identification of curcumin (a), curcumenone (b), curcumenol (c) and zederone (d) as unique chemical markers for the identification.

摘要

背景

中药材郁金可能使用多种植物来源,郁金是温郁金、广西莪术、蓬莪术和姜黄的块根。本研究旨在表征这些不同种郁金的化学特征,并开发一种通过超高效液相色谱-四极杆飞行时间质谱(UHPLC/Q-TOFMS)结合多元统计分析快速鉴别这些品种的方法。

方法

采用UHPLC/Q-TOFMS对来自四种郁金的33个不同批次的郁金代谢组进行分析。对所得的样品编码、tR-m/z对和离子强度进行无监督主成分分析(PCA)和有监督正交偏最小二乘判别分析(OPLS-DA),以表征四种不同品种郁金的化学成分。

结果

根据PCA和OPLS-DA分析,观察到来自四种不同品种的郁金样品在化学成分上存在明显差异。这些结果表明,姜黄素、莪术酮、莪术醇和异莪术酮可分别作为姜黄、温郁金、蓬莪术和广西莪术的独特化学标志物。

结论

本研究开发了一种结合多元统计分析的UHPLC/Q-TOFMS方法,用于鉴别来自四种不同郁金品种(即姜黄、温郁金、蓬莪术和广西莪术)的郁金样品。值得注意的是,这种新方法鉴定出姜黄素(a)、莪术酮(b)、莪术醇(c)和异莪术酮(d)作为独特的化学标志物用于鉴别。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4fff/4850745/d5477fdb3b6d/13020_2016_95_Fig1_HTML.jpg

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