基于定性、定量及化学模式识别分析的蒙药森登-4质量评价
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篇名: 基于定性、定量及化学模式识别分析的蒙药森登-4质量评价
TITLE: Quality evaluation of Mongolian medicine Sendeng-4 based on qualitative and quantitative analysis combined with chemical pattern recognition
摘要: 目的 基于定性、定量及化学模式识别分析对蒙药森登-4进行质量评价,以期为其质量控制提供参考。方法采用高效液相色谱-四极杆/静电场轨道阱高分辨质谱(HPLC-Q-Exactive-MS)技术对森登-4中化学成分进行定性分析;采用高效液相色谱串联质谱(HPLC-MS/MS)技术定量分析15批森登-4样品(S1~S15)中16个成分(没食子酸甲酯、没食子酸乙酯、表儿茶素、二氢杨梅素、京尼平-1-O-β-D-龙胆双糖苷、咖啡酸、儿茶素、柯里拉京、去乙酰车叶草苷酸甲酯、芦丁、栀子苷、木犀草素、杨梅素、槲皮素、阿魏酸、川楝素)的含量;对15批样品进行聚类分析、主成分分析、正交偏最小二乘-判别分析,并以变量重要性投影(VIP)值大于1为标准筛选差异性成分。结果在森登-4中共鉴定出73个化学成分,包括20个黄酮类、16个鞣质类、14个有机酸类成分等。定量分析结果显示,上述16个成分的含量分别为3.683~7.730、2.391~6.952、2275.538~4377.491、2699.188~3537.924、858.266~1377.393、3.366~11.003、140.624~315.683、414.629~978.334、285.501~1510.457、27.799~48.325、3625.415~6309.563、0.506~0.656、442.337~649.283、47.093~59.736、12.942~15.822、127.738~326.649μg/g。聚类分析和主成分分析结果显示,15批森登-4样品可聚为2类:S1~S3、S5~S6、S9~S10、S13样品聚为一类,S4、S7~S8、S11~S12、S14~S15样品聚为另一类;表儿茶素、京尼平-1-O-β-D-龙胆双糖苷、去乙酰车叶草苷酸甲酯、栀子苷的VIP值大于1。结论本研究采用HPLC-Q-Exactive-MS和HPLC-MS/MS技术对森登-4进行了定性、定量分析,并结合化学模式识别分析筛选出了栀子苷、表儿茶素、去乙酰车叶草苷酸甲酯、京尼平-1-O-β-D-龙胆双糖苷4个差异性成分。
ABSTRACT: OBJECTIVE To evaluate the quality of Mongolian medicine Sendeng-4 based on qualitative and quantitative analysis combined with chemical pattern recognition, in order to provide the reference for its quality control. METHODS The chemical components in Sendeng-4 were analyzed qualitatively by HPLC-Q-Exactive-MS. The contents of 16 components (methyl gallate, ethyl gallate, epicatechin, dihydromyricetin, genipin-1-O-β-D-gentiobioside, caffeic acid, catechin, corilagin, deacetylasperulosidic acid methyl ester, rutin, geniposide, luteolin, myricetin, quercetin, ferulic acid, and toosendanin) in 15 batches of Sendeng-4 (sample S1-S15) were quantitatively analyzed by HPLC-MS/MS. Cluster analysis (CA), principal component analysis (PCA), and orthogonal partial least squares discriminant analysis were conducted and variable importance projection (VIP) value greater than 1 was used as the index to screen the differential components. RESULTS A total of 73 chemical components were identified in Sendeng-4, including 20 flavonoids, 16 tannins, 14 organic acids, etc. According to the quantitative analysis, the results exhibited that the average contentsthe of above 16 components in 15 batches of Sendeng-4 were 3.683-7.730, 2.391-6.952, 2 275.538-4 377.491, 2 699.188-3 537.924, 858.266-1 377.393, 3.366-11.003, 140.624-315.683,414.629-978.334, 285.501-1 510.457, 27.799-48.325, 3 625.415-6 309.563, 0.506-0.656, 442.337-649.283, 47.093-59.736, 12.942-15.822, 127.738-326.649 μg/g, respectively. According to the results of CA and PCA, 15 batches of samples could be clustered into two categories: S1-S3, S5-S6, S9-S10 and S13 were clustered into one category; S4, S7-S8, S11-S12, S14-S15 were clustered into one category. VIP values of geniposide, epicatechin, deacetylasperulosidic acid methyl ester and genipin-1-O- β-D-gentiobioside were all greater than 1. CONCLUSIONS HPLC-Q-Exactive-MS and HPLC-MS/MS techniques are employed for the qualitative and quantitative analysis of Sendeng-4. Through chemical pattern recognition analysis, four differential components are identified: geniposide, epicatechin, deacetylasperulosidic acid methyl ester, and genipin-1-O-β-D-gentiobioside.
期刊: 2025年第36卷第09期
作者: 周枫叶;李君;张谦;李荣杰;张微;刘静;王芳;李胜男
AUTHORS: ZHOU Fengye,LI Jun,ZHANG Qian,LI Rongjie,ZHANG Wei,LIU Jing,WANG Fang,LI Shengnan
关键字: 森登-4;定性分析;定量分析;化学模式识别分析;含量测定;质量评价;差异性成分
KEYWORDS: Sendeng-4; qualitative analysis; quantitative analysis; chemical pattern recognition analysis; content
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