Table 3.
Analysis of secondary metabolite synthesis in fermented D. officinale juice
| Classify | Name | m/z | Rt/s | formula | log2FC | ||
|---|---|---|---|---|---|---|---|
| B vs. A | C vs. A | D vs. A | |||||
| organic acids | Succinic acid | 116.9854 | 144.7 | C4H6O4 | 6.19 | 4.11 | 6.17 |
| Citric acid | 191.0198 | 153 | C6H8O7 | 6.02 | 6.35 | 3.59 | |
| trans-Ferulic acid | 193.0505 | 335.5 | C10H10O4 | 1.12 | 1.61 | 1.28 | |
| 2-Hydroxycinnamic acid | 165.0552 | 504.3 | C9H8O3 | - | 1.98 | - | |
| Salicylic acid | 137.0238 | 400.9 | C7H6O3 | - | 0.2 | - | |
| Protocatechuic acid | 153.0192 | 828.4 | C7H6O4 | - | - | 1.83 | |
| Shikimic acid | 173.0454 | 104.9 | C7H10O5 | - | - | 1.44 | |
| fatty acids | L-Malic acid | 134.0177 | 77.5 | C4H6O5 | 4.27 | 2.28 | 6.3 |
| Methyl jasmonate | 207.1373 | 634.9 | C13H20O3 | 2.89 | 6.66 | - | |
| Sinapic acid | 207.0648 | 511.9 | C11H12O5 | 0.88 | - | - | |
| Jasmonic acid | 193.1219 | 706.7 | C12H18O3 | - | 2.33 | - | |
| carbohydrates | Trehalose 6-phosphate | 421.0747 | 78.5 | C12H23O14P | 6.48 | 7.33 | 5.8 |
| D-Maltose | 342.1391 | 141.9 | C12H22O11 | 2.2 | 2.38 | - | |
| D-Glucose 1-phosphate | 261.0361 | 90 | C6H13O9P | - | - | 2.41 | |
| amino acids | Pipecolic acid | 130.0854 | 142.6 | C6H11NO2 | 2.71 | - | - |
| L-Glutamic acid | 130.0486 | 167.9 | C5H9NO4 | 2.22 | 0.67 | - | |
| L-Aspartic acid | 132.0304 | 81.5 | C4H7NO4 | - | 2.86 | - | |
| benzene compounds | 5-Hydroxyconiferyl alcohol | 179.0709 | 286.6 | C10H12O4 | 1.29 | - | - |
| (E)-3-(4-Hydroxyphenyl)-2-propenal | 131.0488 | 650.8 | C9H8O2 | - | 3.59 | - | |
| Coniferyl alcohol | 181.0862 | 457.3 | C10H12O3 | - | 0.6 | 0.96 | |
| imidazoles | 3-Methylxanthine | 166.0496 | 336.9 | C6H6N4O2 | 6.94 | 7.3 | 7.05 |
| 1-Methylxanthine | 166.0497 | 353.3 | C6H6N4O2 | 2.43 | - | 2.39 | |
| vitamins | alpha-Tocopherol | 430.2402 | 495.7 | C29H50O2 | 6.9 | 6.81 | 6.45 |
| Pantothenic acid | 218.1036 | 195.8 | C9H17NO5 | 2.57 | 2.63 | - | |
| terpenoids | Lanosterin | 425.2556 | 814.5 | C30H50O | 5.28 | 5.77 | - |
| Sclareol | 291.2669 | 790.6 | C20H36O2 | 1.89 | 2.01 | 1.74 | |
| flavonoids | Genistein | 271.2257 | 686 | C15H10O5 | 4.71 | 4.41 | 4.68 |
| Naringenin | 271.061 | 647.1 | C15H12O5 | 1.66 | 2.14 | - | |
| alkaloid | Ecgonine methyl ester | 182.1171 | 693.7 | C10H17NO3 | 1.03 | 1.14 | - |
| ester | Benzoate | 121.0294 | 524.3 | C7H6O2 | - | - | 2.95 |
| other | Geranyl diphosphate | 314.0903 | 250.4 | C10H20O7P2 | - | - | 1.91 |