A Theoretical Study On The Chemical Activities Of The Mainly Oregano Essential Oils

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dc.contributor.authorGÖKALP, Faik
dc.contributor.authorDEMİR, Temir Ali
dc.date.accessioned2025-01-21T16:26:43Z
dc.date.available2025-01-21T16:26:43Z
dc.date.issued2019
dc.departmentKırıkkale Üniversitesi
dc.description.abstractThe natural active compounds in Oregano essential oils are extremely beneficial for human health and when used as a drug for treatment. In this study, we have examined the two main Oregano essential oils Thymol and Carvacrol. These oils have many functions; predominantly, in biochemical reactions in metabolism. In our research, we theoretically investigated the chemical activities of Carvacrol and Thymol by using B3LYP/6-31G(d,p) method in the gas, water, and blood phases. The point at which ethanol was used as a solvent was important to the study outcome; hence, in this study; the researchers determined the effective rate of Carvacrol with ethanol to explain the interaction mechanism. © 2021. All Rights Reserved.
dc.description.sponsorshipEskişehir Osmangazi Üniversitesi, ESOGU
dc.identifier.doi10.33435/tcandtc.543411
dc.identifier.endpage91
dc.identifier.issn2587-1722
dc.identifier.issue2
dc.identifier.scopus2-s2.0-85103103855
dc.identifier.scopusqualityQ3
dc.identifier.startpage86
dc.identifier.urihttps://doi.org/10.33435/tcandtc.543411
dc.identifier.urihttps://hdl.handle.net/20.500.12587/23185
dc.identifier.volume3
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherDergiPark
dc.relation.ispartofTurkish Computational and Theoretical Chemistry
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/openAccess
dc.snmzKA_20241229
dc.subjectCarvacrol; Density functional theory (DFT); Ethanol; Oregano; Thymol
dc.titleA Theoretical Study On The Chemical Activities Of The Mainly Oregano Essential Oils
dc.typeArticle

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