Table 5.
Metabolites of date seed polyphenols identified in the urine by ultra-performance liquid chromatography-quadrupole-time-of-flight Mass spectrometry (UPLC-QTOF-MS/MS) analysis following ingestion of date seed treatments.
Compound | Formula | Pseudo-molecular ion (M-H) Exact | Retention Time (min) | Score | Error |
---|---|---|---|---|---|
Hydroxybenzoic acid 1 | C7 H6 O3 | 137.0244 | 3.090 | 99.49 ± 0.05 | 1.43 ± 2.45 |
Hydroxybenzoic acid 2 | C7 H6 O3 | 137.0244 | 4.464 | 97.58 ± 0.84 | 2.86 ± 0.10 |
Protocatechuic acid 1 | C7 H6 O4 | 153.0193 | 4.640 | 96.98 ± 1.06 | 3.73 ± 3.83 |
Protocatechuic acid 2 | C7 H6 O5 | 153.0193 | 5.352 | 95.31 ± 2.06 | 1.64 ± 2.64 |
Vanillic acid 1 | C8 H8 O4 | 167.035 | 3.300 | 95.39 ± 3.67 | 1.66 ± 3.93 |
Vanillic acid 2 | C8 H8 O4 | 167.035 | 4.735 | 93.64 ± 3.29 | 0.23 ± 3.31 |
Vanillic acid sulphate | C8 H8 O7 S | 246.9918 | 3.368 | 93.26 ± 2.10 | 2.19 ± 1.98 |
Ferulic acid sulphate | C10 H6 O7 S | 273.0074 | 4.618 | 93.78 ± 2.44 | 2.31 ± 2.18 |
Methyl epicatechin sulphate | C16 H6 O9 S | 383.0442 | 5.623 | 89.13 ± 3.55 | 0.01 ± 2.04 |
3,4-dihydroxyphenyl valerolactone | C11 H12 O4 | 207.0663 | 5.250 | 97.03 ± 1.76 | 2.56 ± 0.57 |
3,4-dihydroxyphenyl valerolactone glucuronide |
C17 H20 O10 | 383.0984 | 5.126 | 97.30 ± 2.47 | 3.95 ± 2.44 |
3,4-dihydroxyphenyl valerolactone sulphate |
C11 H12 O7 S | 287.0231 | 5.273 | 96.60 ± 2.40 | 1.50 ± 0.89 |
3-hydroxyphenyl acetic acid | C8 H8 O3 | 151.0401 | 6.006 | 91.47 ± 0.83 | 2.95 ± 2.55 |
3-hydroxyphenyl propionic acid | C9 H10 O3 | 165.0557 | 4.968 | 92.76 ± 0.78 | 1.89 ± 2.80 |
3-hydroxyphenyl valeric acid | C11 H14 O3 | 193.087 | 6.979 | 90.11 ± 0.63 | 2.65 ± 3.78 |
3,4-dihydroxyphenyl valeric acid | C11 H14 O4 | 209.0819 | 10.407 | 95.02 ± 1.11 | 0.56 ± 3.56 |
3,4-dihydroxyphenyl valeric acid sulphate |
C11 H14 O7 S | 289.0387 | 10.863 | 92.48 ± 4.85 | 0.91 ± 0.46 |
Hippuric acid | C9 H9 NO3 | 178.051 | 4.921 | 98.47 ± 0.28 | 1.87 ± 1.86 |
Hydroxy hippuric acid 1 | C9 H9 NO4 | 194.0459 | 3.703 | 95.91 ± 1.71 | 0.58 ± 0.76 |
Hydroxy hippuric acid 2 | C9 H9 NO4 | 194.0459 | 4.505 | 94.49 ± 0.78 | 3.28 ± 3.77 |