Please use this identifier to cite or link to this item: https://scidar.kg.ac.rs/handle/123456789/10702
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dc.rights.licenseBY-NC-ND-
dc.contributor.authorAmić A.-
dc.contributor.authorMilenkovic, Dejan-
dc.contributor.authorDimitrić Marković J.-
dc.contributor.authorMarković, Zoran-
dc.date.accessioned2021-04-20T16:26:27Z-
dc.date.available2021-04-20T16:26:27Z-
dc.date.issued2020-
dc.identifier.issn1820-6530-
dc.identifier.urihttps://scidar.kg.ac.rs/handle/123456789/10702-
dc.description.abstract© 2020, Serbian Society of Computational Mechanics. Free radical scavenging potency of physiologically active equol molecule, derived by gut microbiota from soy isoflavone daidzein, was investigated by using M06-2X/6-311++G(d, p) level of theory, accompanied with the TST and Eckart tunneling corrections for the estimation of rate constants. Phenolic hydrogens of equol are recognized as much more abstractable than C-ring hydrogens. This finding is opposite to the one very recently suggested, but in accordance with well-known facts related to the flavonoid chemistry and phenolic O-H vs C-H reactivity.-
dc.rightsopenAccess-
dc.rights.urihttps://creativecommons.org/licenses/by-nc-nd/4.0/-
dc.sourceJournal of the Serbian Society for Computational Mechanics-
dc.titleDo Equol's C-ring hydrogens contribute to free radical scavenging?-
dc.typearticle-
dc.identifier.doi10.24874/jsscm.2020.01.05-
dc.identifier.scopus2-s2.0-85089280159-
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