Integrated GC–MS and Network Pharmacology Reveal Component Changes of <i>Atractylodis Rhizoma</i> During Bran‐Fried and Anti‐Ulcerative Colitis Mechanisms

Raw Atractylodis Rhizoma (RAR) is a traditional Chinese medicine that has multiple effects and is effective in treating ulcerative colitis (UC). Bran-fried Atractylodis Rhizoma (BFAR) is a commonly processed preparation and has better therapeutic effects on UC. However, the underlying changes in the chemical composition of bran-fried RAR and molecular mechanisms related to UC remain unclear. In this study, GC-MS analysis was employed to identify the chemical constituents of RAR and BFAR, and network pharmacology combined with molecular docking was used to elucidate their potential mechanisms of action against UC. A total of 95 components were identified. Comparative analysis revealed that bran-fried significantly altered the chemical profile of RAR, with 2,6,11-trimethyldodecane and elemol identified as key compounds whose contents markedly decreased after processing. Network pharmacology analysis screened 38 active components and 201 common targets. Enrichment analysis indicated that their functions are closely related to the PI3K-Akt signaling pathway and cancer pathways, with BFAR exhibiting a broader component-target interaction network than RAR. Molecular docking validated strong binding activity between the core active components and key targets. These findings provide a robust theoretical foundation and data support for standardizing processing techniques, quality control, and clinical application of RAR and BFAR.

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Publication Details

Journal
Biomedical Chromatography
Published
2026-05-22
DOI
https://doi.org/10.1002/bmc.70440
Primary Topic
Traditional Chinese Medicine Analysis
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article
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article

Integrated GC–MS and Network Pharmacology Reveal Component Changes of Atractylodis Rhizoma During Bran‐Fried and Anti‐Ulcerative Colitis Mechanisms

Yingxuan Li, Jianxia Wang, Ge Xun, Congkun Xiang et al.
Biomedical Chromatography
Traditional Chinese Medicine Analysis
article

Integrated GC–MS and Network Pharmacology Reveal Component Changes of Atractylodis Rhizoma During Bran‐Fried and Anti‐Ulcerative Colitis Mechanisms

Yingxuan Li, Jianxia Wang, Ge Xun, Congkun Xiang, Xiaoguang Zhang, Wei Zhang, Tao Lv, Liping Zhang, Qiao Wang, Jie Cheng, Jiong Chen, Yan Fu, Zishang Zhang
article en

Abstract

Raw Atractylodis Rhizoma (RAR) is a traditional Chinese medicine that has multiple effects and is effective in treating ulcerative colitis (UC). Bran-fried Atractylodis Rhizoma (BFAR) is a commonly processed preparation and has better therapeutic effects on UC. However, the underlying changes in the chemical composition of bran-fried RAR and molecular mechanisms related to UC remain unclear. In this study, GC-MS analysis was employed to identify the chemical constituents of RAR and BFAR, and network pharmacology combined with molecular docking was used to elucidate their potential mechanisms of action against UC. A total of 95 components were identified. Comparative analysis revealed that bran-fried significantly altered the chemical profile of RAR, with 2,6,11-trimethyldodecane and elemol identified as key compounds whose contents markedly decreased after processing. Network pharmacology analysis screened 38 active components and 201 common targets. Enrichment analysis indicated that their functions are closely related to the PI3K-Akt signaling pathway and cancer pathways, with BFAR exhibiting a broader component-target interaction network than RAR. Molecular docking validated strong binding activity between the core active components and key targets. These findings provide a robust theoretical foundation and data support for standardizing processing techniques, quality control, and clinical application of RAR and BFAR.

Biomedical ChromatographyVol. 40(7)
Hebei Medical University (CN), Hospital of Hebei Province (CN), Hebei University of Chinese Medicine (CN)
Openalex Percentile: Top 3%
Traditional Chinese Medicine Analysis
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