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Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology

The contents of ellagic acid and kaempferol-3-O-rutinoside, the chief active components of raspberry, are considered the quality control indices of raspberry. This work employed the ant colony neural network (ACO-BPNN) to optimize their extraction processes, and the combination of network pharmacolo...

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Detalles Bibliográficos
Autores principales: Chen, Xuming, Shi, Xiaochun, Li, Xiaohong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10663849/
https://www.ncbi.nlm.nih.gov/pubmed/38027894
http://dx.doi.org/10.1016/j.heliyon.2023.e21826
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author Chen, Xuming
Shi, Xiaochun
Li, Xiaohong
author_facet Chen, Xuming
Shi, Xiaochun
Li, Xiaohong
author_sort Chen, Xuming
collection PubMed
description The contents of ellagic acid and kaempferol-3-O-rutinoside, the chief active components of raspberry, are considered the quality control indices of raspberry. This work employed the ant colony neural network (ACO-BPNN) to optimize their extraction processes, and the combination of network pharmacology and molecular docking technology to unveil the potential pharmacological effects of these components. Based on the single-factor test (ultrasonic time, ethanol concentration, ultrasonic temperature, and solid-liquid ratio), a factorial experiment with 4-factors and 3-levels was conducted in parallel for 3 times. The multi-factor analysis of variance results revealed high-order interactions among the factors. Then, the ACO-BPNN model was established to characterize the complex relationship of experimental data. After further verification, relative errors were all less than 8 %, implying the model's effectiveness and reliability. Moreover, with the network pharmacology, 66 key targets were screened out and mainly concentrated in PI3K-AKT, MAPK, and Ras signal pathways. Molecular docking revealed the binding sites between active components and key targets.
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spelling pubmed-106638492023-11-04 Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology Chen, Xuming Shi, Xiaochun Li, Xiaohong Heliyon Research Article The contents of ellagic acid and kaempferol-3-O-rutinoside, the chief active components of raspberry, are considered the quality control indices of raspberry. This work employed the ant colony neural network (ACO-BPNN) to optimize their extraction processes, and the combination of network pharmacology and molecular docking technology to unveil the potential pharmacological effects of these components. Based on the single-factor test (ultrasonic time, ethanol concentration, ultrasonic temperature, and solid-liquid ratio), a factorial experiment with 4-factors and 3-levels was conducted in parallel for 3 times. The multi-factor analysis of variance results revealed high-order interactions among the factors. Then, the ACO-BPNN model was established to characterize the complex relationship of experimental data. After further verification, relative errors were all less than 8 %, implying the model's effectiveness and reliability. Moreover, with the network pharmacology, 66 key targets were screened out and mainly concentrated in PI3K-AKT, MAPK, and Ras signal pathways. Molecular docking revealed the binding sites between active components and key targets. Elsevier 2023-11-04 /pmc/articles/PMC10663849/ /pubmed/38027894 http://dx.doi.org/10.1016/j.heliyon.2023.e21826 Text en © 2023 The Authors. Published by Elsevier Ltd. https://creativecommons.org/licenses/by-nc-nd/4.0/This is an open access article under the CC BY-NC-ND license (http://creativecommons.org/licenses/by-nc-nd/4.0/).
spellingShingle Research Article
Chen, Xuming
Shi, Xiaochun
Li, Xiaohong
Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology
title Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology
title_full Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology
title_fullStr Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology
title_full_unstemmed Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology
title_short Multi-component analyses of raspberry: Optimization of extraction procedure and network pharmacology
title_sort multi-component analyses of raspberry: optimization of extraction procedure and network pharmacology
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10663849/
https://www.ncbi.nlm.nih.gov/pubmed/38027894
http://dx.doi.org/10.1016/j.heliyon.2023.e21826
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