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. 2020 Aug 18;68(36):9804–9815. doi: 10.1021/acs.jafc.0c03587

Table 1. Metabolites of EGCG Fermentation with HFS Annotated by UHPLC-Orbitrap-MS.

ID RT (min) tentative identification formula monoisotopic mass measured mass Δmass (ppm)
M00 6.38 EGCGa C22H18O11 458.08491 458.08481 0.22
M01 5.19 EGCa C15H14O7 306.07395 306.07403 0.16
M02 2.43 gallic acida C7H6O5 170.02152 170.02147 0.29
M03 2.80 pyrogallola C6H6O3 126.03169 126.03168 0.08
M04 6.03 1-(3′,4′-dihydroxyphenyl)-3-(2″,4″,6″-trihydroxyphenyl)propan-2-ol C15H16O6 292.09469 292.09460 0.31
M05 5.12 5-(3′,4′-dihydroxyphenyl)-γ-valerolactone C11H12O4 208.07356 208.07346 0.48
M06 5.46 5-(3′,4′,5′-trihydroxyphenyl)valeric acid C11H14O5 226.08412 226.08410 0.31
M07 13.12 4-phenylbutyric acid C10H12O2 164.08373 164.08372 0.06
M08 5.85 3-(3′,4′-dihydroxyphenyl)propionic acida C9H10O4 182.05791 182.05788 0.16
M09 7.07 3-(4′-hydroxyphenyl)propionic acida C9H10O3 166.06299 166.06291 0.48
M10 8.28 3-phenylpropionic acid C9H10O2 150.06808 150.06806 0.67
M11 4.36 2-(3′,4′-dihydroxyphenyl)acetic acid C8H8O4 168.04226 168.04215 0.65
M12 5.87 2-(4′-hydroxyphenyl)acetic acida C8H8O3 152.04734 152.04730 0.26
M13 9.20 phenylacetic acid C8H8O2 136.05243 136.05243 0.00
M14 5.37 4-hydroxybenzoic acida C7H6O3 138.03169 138.03167 0.14
a

Confirmed with authentic standards.