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基于非靶向代谢组学的兴安白芷不同部位差异代谢物分析
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          王 星 ,周紫珊,田恩伟(南方医科大学中医药学院,广州 510515)
          中图分类号  R931.6      文献标志码  A      文章编号  1001-0408(2026)09-1161-06
          DOI  10.6039/j.issn.1001-0408.2026.09.09

          摘  要  目的  探讨兴安白芷根、茎、叶的代谢物差异,为白芷药用资源的开发和利用提供参考。方法  采用超高效液相色谱-串联
          质谱非靶向代谢组学技术对兴安白芷根、茎、叶进行代谢物检测。采用多元统计分析方法筛选差异代谢物并进行聚类分析,进一
          步对差异代谢物进行京都基因与基因组百科全书(KEGG)通路富集分析。结果  在兴安白芷根、茎、叶中共检测出769种代谢物,
          其中脂质类(14.31%)、生物碱类(13.91%)、氨基酸及其衍生物(13.65%)化合物占比较高,香豆素类化合物占比为3.25%。主成分
          分析、正交偏最小二乘判别分析及聚类分析结果一致表明,根、茎、叶的代谢物存在一定差异。茎与根的差异代谢物共205种(82
          种上调,123种下调),叶与根的差异代谢物共326种(247种上调,79种下调),叶与茎的差异代谢物共293种(263种上调,30种下
          调)。进一步对不同部位中香豆素类差异代谢物进行分析发现,(R)-氧化前胡素、4-羟基香豆素、4-甲基伞形酮乙酸酯等在叶中的
          相对含量较高。KEGG通路富集分析显示,差异代谢物主要富集于苯丙烷类物质生物合成、ABC转运蛋白等通路。结论  兴安白
          芷根、茎、叶的代谢物存在较大差异。叶中香豆素类成分高度富集,其合成与转运可能与苯丙烷类生物合成、ABC转运蛋白通路
          的协同作用相关。
          关键词  兴安白芷;非药用部位;非靶向代谢组学;差异代谢物;资源开发;UPLC-MS/MS


          Analysis  of  differential  metabolites  in  different  parts  of  Angelica  dahurica ((Fisch. ex  Hoffm.))  Benth.  et
          Hook. f. ex Franch. et Savat. based on untargeted metabolomics
          WANG Xing,ZHOU Zishan,TIAN Enwei(School  of  Traditional  Chinese  Medicine,  Southern  Medical
          University, Guangzhou 510515, China)

          ABSTRACT   OBJECTIVE  To  investigate  the  metabolic  differences  in  roots,  stems  and  leaves  of  Angelica  dahurica (Fisch.ex
          Hoffm.)  Benth.  et  Hook.  f.  ex  Franch.  et  Savat. (shortened  for  A.  dahurica),  and  to  provide  a  basis  for  the  development  and
          utilization  of  its  medicinal  resources.  METHODS  UPLC-MS/MS  untargeted  metabolomics  technology  was  employed  to  detect
          metabolites in roots, stems and leaves of A. dahurica. Multivariate statistical analysis was used to screen differential metabolites and
          perform  cluster  analysis.  Furthermore,  Kyoto  Encyclopedia  of  Genes  and  Genomes (KEGG)  pathway  enrichment  analysis  was
          conducted  on  these  differential  metabolites.  RESULTS  A  total  of  769  metabolites  were  identified  in  roots,  stems  and  leaves  of A.
          dahurica. Among them, lipids, alkaloids, amino acids and their derivatives accounted for the highest proportion, which accounted
          for 14.31%, 13.91% and 13.65%, respectively, and the coumarin compounds accounted for 3.25%. Results of principal component
          analysis,  orthogonal  partial  least  squares-discriminant  analysis  and  cluster  analysis  indicated  that  there  were  certain  differences  in
          metabolites among the three tissues. A total of 205 differential metabolites were identified between stems and roots (82 up-regulated
          and  123  down-regulated),  326  differential  metabolites  between  leaves  and  roots (247  up-regulated  and  79  down-regulated),  and
          293  differential  metabolites  between  the  leaves  and  stems (263  up-regulated  and  30  down-regulated).  Further  analysis  of  the
          differential  coumarin  metabolites  in  different  plant  parts  revealed  that  several  compounds,  including (R)-oxypeucedanin,  4-
          hydroxycoumarin,  4-methylumbelliferyl  acetate,  exhibited  relatively  high  contents  in  the  leaves.  KEGG  pathway  enrichment
          analysis  indicated  that  differential  metabolites  predominantly  accumulated  in  the  phenylpropanoid  biosynthesis  and ABC  transporter
          pathways.  CONCLUSIONS  There  are  significant  differences  in  metabolites  among  roots,  stems  and  leaves  of  A.  dahurica.
          Coumarin compounds are highly enriched in the leaves, and their synthesis and transport may be related to the synergistic effect of
          the phenylpropanoid biosynthesis pathway and the ABC transporter pathway.
          KEYWORDS    Angelica  dahurica (Fisch. ex  Hoffm.)  Benth.  et  Hook.  f.  ex  Franch.  et  Savat.;  non-medicinal  parts;  untargeted
          metabolomics; differential metabolites; resource development; UPLC-MS/MS


             Δ 基金项目 广东省基础与应用基础研究基金项目(No.2024A-
                                                                 白芷为伞形科植物白芷 Angelica dahurica(Fisch.
          1515010875)                                        ex Hoffm.)Benth. et Hook. f. 或杭白芷 A.dahurica(Fisch.
             *第一作者 硕士研究生。研究方向:中药质量评价。E-mail:
                                                             ex Hoffm.)Benth. et Hook. f. var. formosana(Boiss.)Shan
          wangxing1022@126.com
             # 通信作者 副教授,硕士生导师,博士。研究方向:中药质量评                  et Yuan的干燥根,为我国常用中药材,具有解表散寒、祛
          价。E-mail:tianenwei@126.com                         风止痛、宣通鼻窍、燥湿止带、消肿排脓的功效,临床上


          中国药房  2026年第37卷第9期                                                China Pharmacy  2026 Vol. 37  No. 9    · 1161 ·
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