Pregled bibliografske jedinice broj: 1069437
Do Equol’s C-ring Hydrogens Contribute to Free Radical Scavenging?
Do Equol’s C-ring Hydrogens Contribute to Free Radical Scavenging? // Journal of the Serbian Society for Computational Mechanics, special issue (2020), 45, 58 (međunarodna recenzija, članak, znanstveni)
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Naslov
Do Equol’s C-ring Hydrogens Contribute to Free
Radical Scavenging?
Autori
Amić, Ana ; Milenković, Dejan ; Dimitrić Marković, Jasmina ; Marković Zoran
Izvornik
Journal of the Serbian Society for Computational Mechanics (1820-6530) Special issue
(2020);
45, 58
Vrsta, podvrsta i kategorija rada
Radovi u časopisima, članak, znanstveni
Ključne riječi
Equol ; free radical scavenging ; fHAT mechanism ; tunneling
Sažetak
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.
Izvorni jezik
Engleski
Znanstvena područja
Kemija
Citiraj ovu publikaciju:
Časopis indeksira:
- Web of Science Core Collection (WoSCC)
- Emerging Sources Citation Index (ESCI)
- Scopus
