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[基于超高效液相色谱-四极杆飞行时间质谱法分析茜草炭前后化学成分的变化]

[Changes of chemical constituents in Rubiae Radix et Rhizoma before and after carbonized by UPLC-Q-TOF-MS method].

作者信息

Chen Yi, Shan Ming-Qiu, Wang Hai-Li, Xue Lu, Zhang Li, Ding An-Wei

机构信息

Jiangsu Collaborative Innovation Center of Chinese Medicinal Resources Industrialization, Jiangsu Key Laboratory for High Technology Research of Traditional Chinese Medicine Formulae, and National and Local Collaborative Engineering Center of Chinese Medicinal Resources Industrialization and Formulae Innovative Medicine, Nanjing University of Chinese Medicine, Nanjing 210023, China.

出版信息

Zhongguo Zhong Yao Za Zhi. 2017 Mar;42(5):923-930. doi: 10.19540/j.cnki.cjcmm.20170121.035.

Abstract

In order to explore the effect on chemical constituents after carbonized, the changes of chemical constituents in raw and carbonized Rubiae Radix et Rhizoma were analyzed by UPLC-Q-TOF-MS. The research also used principal component analysis(PCA) and orthogonal partial least squares discriminant analysis(OPLS-DA) for data statistics to find out the main differences on components before and after carbonized. The accurate m/z values of Q-TOF-MS and Q-TOF-MS-MS fragments were applied to identify the structures. The results showed that 6 more discrepant constituents were existed between raw and carbonized Rubiae Radix et Rhizoma. Three constituents were selected as the main discrepant components according to the peak area (276 nm) and identified, as lucidin, xanthopurpurin and 1,3,6-trihydroxy-2-methylanthraquinone. After carbonized, contents of xanthopurpurin and 1,3,6-trihydroxy-2-methylanthraquinone were observably increasing, while lucidin was obviously decreasing. They could be used as the chemical markers for the differentiation between raw and carbonized Rubiae Radix et Rhizoma. The results of this experiment played an important role in the study of processing principle of carbonized Rubiae Radix et Rhizoma. It also provided important evidences for the interpretation of effective material based on carbonized Rubiae Radix et Rhizoma.

摘要

为探究茜草炭炮制后化学成分的变化,采用超高效液相色谱-四极杆飞行时间质谱联用仪(UPLC-Q-TOF-MS)分析茜草生品与炭品中化学成分的变化情况。研究还运用主成分分析(PCA)和正交偏最小二乘法判别分析(OPLS-DA)对数据进行统计,以找出炭品与生品在成分上的主要差异。通过Q-TOF-MS和Q-TOF-MS-MS碎片的精确质荷比(m/z)值来鉴定结构。结果表明,茜草生品与炭品之间存在6种以上差异成分。根据峰面积(276 nm)选取3种成分作为主要差异成分并进行鉴定,分别为鲁比定、紫黄茜素和1,3,6-三羟基-2-甲基蒽醌。炭制后,紫黄茜素和1,3,6-三羟基-2-甲基蒽醌的含量明显增加,而鲁比定明显降低。它们可作为茜草生品与炭品鉴别的化学标志物。本实验结果对茜草炭炮制原理的研究具有重要意义,也为阐释茜草炭的药效物质基础提供了重要依据。

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