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. 2024 Jun 6;29(11):2702. doi: 10.3390/molecules29112702

Table 2.

Molecular formulae and calculated monoisotopic masses of the hypothesized Michael adducts with Cys.

Compound Chemical Formula Th. [M]+/[M + H]+
Cyanidin-3-arabinoside C23H24NO12S+ 538.10192
Cyanidin-3-glucoside/galactoside C24H26NO13S+ 568.11248
Delphinidin-3-arabinoside C23H24NO13S+ 554.09683
Delphinidin-3-glucoside/galactoside C24H26NO14S+ 584.10740
Myricetin C18H15NO12S 470.03932
Myricetin-3-glucoside/galactoside C24H25NO15S 600.10231
Petunidin-3-arabinoside C24H26NO13S+ 568.11248
Petunidin-3-glucoside/galactoside C25H28NO14S+ 598.12304
Quercetin-3-arabinoside/xyloside C23H23NO13S 554.09683
Quercetin-3-glucoside/galactoside C25H27NO13S 582.12813
Quercetin-3-rhamnoside C24H25NO13S 568.11248
Quercetin C18H15NO9S 422.05457
Quercetin-3-glucuronide C24H23NO15S 598.08666