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dc.creatorGawlik, Maciej
dc.creatorSavić, Vladimir
dc.creatorJovanović, Miloš
dc.creatorSkibiński, Robert
dc.date.accessioned2020-05-28T11:08:29Z
dc.date.available2020-05-28T11:08:29Z
dc.date.issued2020
dc.identifier.issn1420-3049
dc.identifier.urihttps://farfar.pharmacy.bg.ac.rs/handle/123456789/3569
dc.description.abstractEstablishing the metabolism pathway of the drug undergoing the hepatic biotransformation pathway is one of the most important aspects in the preclinical discovery process since the presence of toxic or reactive metabolites may result in drug withdrawal from the market. In this study, we present the structural elucidation of six, not described yet, metabolites of an antipsychotic molecule: molindone. The elucidation of metabolites was supported with a novel photocatalytical approach with the use of WO3 and WS2 assisted photochemical reactions. An UHPLC-ESI-Q-TOF combined system was used for the registration of all obtained metabolite profiles as well as to record the high resolution fragmentation spectra of the observed transformation products. As a reference in the in vitro metabolism simulation method, the incubation with human liver microsomes was used. Chemometric comparison of the obtained profiles pointed out the use of the WO3 approach as being more convenient in the field of drug metabolism studies. Moreover, the photocatalysis was used in the direction of the main drug metabolite synthesis in order to further isolation and characterization.en
dc.publisherMDPI AG
dc.rightsopenAccess
dc.rights.urihttps://creativecommons.org/licenses/by/4.0/
dc.sourceMolecules
dc.subjectChemometric analysis
dc.subjectHLM
dc.subjectMass spectrometry
dc.subjectMetabolites
dc.subjectPhotocatalysis
dc.titleMimicking of phase I metabolism reactions of molindone by HLM and photocatalytic methods with the use of UHPLC-MS/MSen
dc.typearticle
dc.rights.licenseBY
dcterms.abstractСавић, Владимир; Гаwлик, Мациеј; Јовановић, Милош; Скибиńски, Роберт;
dc.citation.volume25
dc.citation.issue6
dc.citation.rankM22
dc.identifier.wos000530248700110
dc.identifier.doi10.3390/molecules25061367
dc.identifier.scopus2-s2.0-85082064644
dc.identifier.fulltexthttps://farfar.pharmacy.bg.ac.rs/bitstream/id/7790/Mimicking_of_Phase_pub_2020.pdf
dc.type.versionpublishedVersion


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