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Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant

Plants of the genus Strobilanthes have notable use in folklore medicines as well as being used for pharmacological purposes. The present work explored the biological predispositions of Strobilanthes glutinosus and attempted to accomplish a comprehensive chemical profile through GC-MS of different fr...

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Autores principales: Aziz, Marya, Ahmad, Saeed, Khurshid, Umair, Pervaiz, Irfan, Lodhi, Arslan Hussain, Jan, Nasrullah, Khurshid, Sameera, Arshad, Muhammad Adeel, Ibrahim, Mohamed M., Mersal, Gaber A. M., Alenazi, Fahaad S., Awadh Saleh Alamri, Ahmed, Butt, Juwairiya, Saleem, Hammad, El-Bahy, Zeinhom M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9608989/
https://www.ncbi.nlm.nih.gov/pubmed/36296481
http://dx.doi.org/10.3390/molecules27206885
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author Aziz, Marya
Ahmad, Saeed
Khurshid, Umair
Pervaiz, Irfan
Lodhi, Arslan Hussain
Jan, Nasrullah
Khurshid, Sameera
Arshad, Muhammad Adeel
Ibrahim, Mohamed M.
Mersal, Gaber A. M.
Alenazi, Fahaad S.
Awadh Saleh Alamri, Ahmed
Butt, Juwairiya
Saleem, Hammad
El-Bahy, Zeinhom M.
author_facet Aziz, Marya
Ahmad, Saeed
Khurshid, Umair
Pervaiz, Irfan
Lodhi, Arslan Hussain
Jan, Nasrullah
Khurshid, Sameera
Arshad, Muhammad Adeel
Ibrahim, Mohamed M.
Mersal, Gaber A. M.
Alenazi, Fahaad S.
Awadh Saleh Alamri, Ahmed
Butt, Juwairiya
Saleem, Hammad
El-Bahy, Zeinhom M.
author_sort Aziz, Marya
collection PubMed
description Plants of the genus Strobilanthes have notable use in folklore medicines as well as being used for pharmacological purposes. The present work explored the biological predispositions of Strobilanthes glutinosus and attempted to accomplish a comprehensive chemical profile through GC-MS of different fractions concerning polarity (chloroform and n-butanol) and LC-ESI-MS of methanolic extract by both positive and negative ionization modes. The biological characteristics such as antioxidant potential were assessed by applying six different methods. The potential for clinically relevant enzyme (α-amylase, α-glucosidase, and tyrosinase) inhibition was examined. The DPPH, ABTS, CUPRAC, and FRAP results revealed that the methanol fraction presented efficient results. The phosphomolybdenum assay revealed that the n-hexane fraction showed the most efficient results, while maximum metal chelation potential was observed for the chloroform fraction. The GC-MS profiling of n-butanol and chloroform fractions revealed the existence of several (110) important compounds presenting different classes (fatty acids, phenols, alkanes, monoterpenes, diterpenes, sesquiterpenoids, and sterols), while LC-ESI-MS tentatively identified the presence of 44 clinically important secondary metabolites. The n-hexane fraction exhibited the highest potential against α-amylase (497.98 mm ACAE/g extract) and α-glucosidase (605.85 mm ACAE/g extract). Significant inhibitory activity against tyrosinase enzyme was displayed by fraction. Six of the prevailing compounds from the GC-MS study (lupeol, beta-amyrin, stigmasterol, gamma sitosterol, 9,12-octadecadienoic acid, and n-hexadecanoic acid) were modelled against α-glucosidase and α-amylase enzymes along with a comparison of binding affinity to standard acarbose, while three compounds identified through LC-ESI-MS were docked to the mushroom tyrosinase enzyme and presented with significant biding affinities. Thus, it is assumed that S. glutinosus demonstrated effective antioxidant and enzyme inhibition prospects with effective bioactive molecules, potentially opening the door to a new application in the field of medicine.
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spelling pubmed-96089892022-10-28 Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant Aziz, Marya Ahmad, Saeed Khurshid, Umair Pervaiz, Irfan Lodhi, Arslan Hussain Jan, Nasrullah Khurshid, Sameera Arshad, Muhammad Adeel Ibrahim, Mohamed M. Mersal, Gaber A. M. Alenazi, Fahaad S. Awadh Saleh Alamri, Ahmed Butt, Juwairiya Saleem, Hammad El-Bahy, Zeinhom M. Molecules Article Plants of the genus Strobilanthes have notable use in folklore medicines as well as being used for pharmacological purposes. The present work explored the biological predispositions of Strobilanthes glutinosus and attempted to accomplish a comprehensive chemical profile through GC-MS of different fractions concerning polarity (chloroform and n-butanol) and LC-ESI-MS of methanolic extract by both positive and negative ionization modes. The biological characteristics such as antioxidant potential were assessed by applying six different methods. The potential for clinically relevant enzyme (α-amylase, α-glucosidase, and tyrosinase) inhibition was examined. The DPPH, ABTS, CUPRAC, and FRAP results revealed that the methanol fraction presented efficient results. The phosphomolybdenum assay revealed that the n-hexane fraction showed the most efficient results, while maximum metal chelation potential was observed for the chloroform fraction. The GC-MS profiling of n-butanol and chloroform fractions revealed the existence of several (110) important compounds presenting different classes (fatty acids, phenols, alkanes, monoterpenes, diterpenes, sesquiterpenoids, and sterols), while LC-ESI-MS tentatively identified the presence of 44 clinically important secondary metabolites. The n-hexane fraction exhibited the highest potential against α-amylase (497.98 mm ACAE/g extract) and α-glucosidase (605.85 mm ACAE/g extract). Significant inhibitory activity against tyrosinase enzyme was displayed by fraction. Six of the prevailing compounds from the GC-MS study (lupeol, beta-amyrin, stigmasterol, gamma sitosterol, 9,12-octadecadienoic acid, and n-hexadecanoic acid) were modelled against α-glucosidase and α-amylase enzymes along with a comparison of binding affinity to standard acarbose, while three compounds identified through LC-ESI-MS were docked to the mushroom tyrosinase enzyme and presented with significant biding affinities. Thus, it is assumed that S. glutinosus demonstrated effective antioxidant and enzyme inhibition prospects with effective bioactive molecules, potentially opening the door to a new application in the field of medicine. MDPI 2022-10-14 /pmc/articles/PMC9608989/ /pubmed/36296481 http://dx.doi.org/10.3390/molecules27206885 Text en © 2022 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Aziz, Marya
Ahmad, Saeed
Khurshid, Umair
Pervaiz, Irfan
Lodhi, Arslan Hussain
Jan, Nasrullah
Khurshid, Sameera
Arshad, Muhammad Adeel
Ibrahim, Mohamed M.
Mersal, Gaber A. M.
Alenazi, Fahaad S.
Awadh Saleh Alamri, Ahmed
Butt, Juwairiya
Saleem, Hammad
El-Bahy, Zeinhom M.
Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant
title Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant
title_full Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant
title_fullStr Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant
title_full_unstemmed Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant
title_short Comprehensive Biological Potential, Phytochemical Profiling Using GC-MS and LC-ESI-MS, and In-Silico Assessment of Strobilanthes glutinosus Nees: An Important Medicinal Plant
title_sort comprehensive biological potential, phytochemical profiling using gc-ms and lc-esi-ms, and in-silico assessment of strobilanthes glutinosus nees: an important medicinal plant
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9608989/
https://www.ncbi.nlm.nih.gov/pubmed/36296481
http://dx.doi.org/10.3390/molecules27206885
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