Combining in vitro, in vivo and in silico approaches to evaluate nutraceutical potentials and chemical fingerprints of Moltkia aurea and Moltkia coerulea

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dc.contributor.authorZengin, Gökhan
dc.contributor.authorCeylan, Ramazan
dc.contributor.authorKatanic, Jelena
dc.contributor.authorMollica, Adriano
dc.contributor.authorAktümsek, Abdurrahman
dc.contributor.authorBoroja, Tatjana
dc.contributor.authorMatic, Sanja
dc.date.accessioned2020-03-26T19:34:24Z
dc.date.available2020-03-26T19:34:24Z
dc.date.issued2017
dc.departmentSelçuk Üniversitesien_US
dc.description.abstractMethanolic extracts of Moltkia aurea Boiss. (MA) and Moltkia coerulea (Wild.) Lehm. (MC) were investigated for their antioxidant capacity and enzymatic inhibitory potential against acetylcholinesterase, butyrylcholinesterase, alpha-amylase, alpha-glucosidase, and tyrosinase in vitro. MA and MC were also explored for their antimicrobial effect, as well as for their possible genotoxic/antigenotoxic potential on Drosophila melanogaster in vivo. The total bioactive components (phenolic (TPC) and flavonoid contents (TFC)) were determined and liquid chromatography-tandem mass spectrometry (LC-MS/MS) metabolite profiling of MA and MC appraised. The plausible docking poses of bioactive compounds to key enzymes were further studied using molecular modelling approach. MA proved to be a better antioxidant with higher TPC and TFC compared to MC. Protocatechuic acid, rutin, hesperidin and malic acid were the most abundant in these extracts. Both MA and MC exhibited antigenotoxic potential with a %R in DNA damage of 60.90 and 53.14% respectively. The docking studies revealed that rutin, hesperidin, and rosmarinic acid have the best scores for all the enzymes tested. MA and MC were found to be rich in phytochemicals with potent antioxidant, antimicrobial, and antigenotoxic activities that can be further studied for the management of neurodegenerative complications, diabetes, and hyperpigmentation. (C) 2017 Elsevier Ltd. All rights reserved.en_US
dc.description.sponsorshipResearch Foundation of Selcuk University (BAP)Selcuk University [17401003]; Ministry of Education, Science and Technological Development, Republic of Serbia [III 43004, III 41010]en_US
dc.description.sponsorshipThe authors wish to thank the Research Foundation of Selcuk University (BAP) for providing facilities and encouragement (Project No: 17401003). One part of this work was financed by the Ministry of Education, Science and Technological Development, Republic of Serbia, Grants No. III 43004 and III 41010.en_US
dc.identifier.doi10.1016/j.fct.2017.04.004en_US
dc.identifier.endpage553en_US
dc.identifier.issn0278-6915en_US
dc.identifier.issn1873-6351en_US
dc.identifier.pmid28390858en_US
dc.identifier.scopusqualityQ1en_US
dc.identifier.startpage540en_US
dc.identifier.urihttps://dx.doi.org/10.1016/j.fct.2017.04.004
dc.identifier.urihttps://hdl.handle.net/20.500.12395/34892
dc.identifier.volume107en_US
dc.identifier.wosWOS:000408596500003en_US
dc.identifier.wosqualityQ1en_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.indekslendigikaynakPubMeden_US
dc.language.isoenen_US
dc.publisherPERGAMON-ELSEVIER SCIENCE LTDen_US
dc.relation.ispartofFOOD AND CHEMICAL TOXICOLOGYen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.selcuk20240510_oaigen_US
dc.subjectNatural productsen_US
dc.subjectMolecular dockingen_US
dc.subjectAntioxidanten_US
dc.subjectAntigenotoxicen_US
dc.subjectAntimicrobialen_US
dc.subjectAnti-tyrosinaseen_US
dc.titleCombining in vitro, in vivo and in silico approaches to evaluate nutraceutical potentials and chemical fingerprints of Moltkia aurea and Moltkia coeruleaen_US
dc.typeArticleen_US

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