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. 2019 Jun 18;24(12):2266. doi: 10.3390/molecules24122266

Table 1.

Differential Metabolite Pathway Analysis Results.

Compound ID Metabolite Molecular Formula Mode Ret. Time M/Z Trend
HMDB0000158 Δl-tyrosine C9H11NO3 ESI - 1.3987 180.0632 -
HMDB0006236 Phenylacetaldehyde C8H8O ESI + 1.5029 121.0663 -
HMDB0000205 Phenylpyruvic acid C9H8O3 ESI - 3.5141 163.0386 -
HMDB0000159 Δl-phenylalanine C9H11NO2 ESI + 2.1193 120.0800 -
HMDB0003426 Pantetheine C11H22N2O4S ESI + 2.5712 279.1378 -
HMDB0000574 l-Cysteine C3H7NO2S ESI + 4.8468 122.0283 -
HMDB0000210 Pantothenic Acid C9H17NO5 ESI - 2.3662 218.1016 -
HMDB0000300 Uracil C7H10N2OS ESI + 1.5955 113.0465 +
HMDB0000929 Tryptophan C11H12N2O2 ESI + 2.9052 205.1002 +
HMDB0000259 Serotonin C10H12N2O ESI + 1.8983 177.1051 -
HMDB0000684 l-Kynurenine C10H12N2O3 ESI + 2.3458 191.0838 -
HMDB0000734 Indoleacrylic acid C11H9NO2 ESI - 6.86 186.0561 +
HMDB0000978 4-(2-Aminophenyl)-2,4-dioxobutanoic acid C10H9NO4 ESI + 3.434 208.0615 -
HMDB0000197 3-Indoleacetic Acid C10H9NO2 ESI - 6.1042 174.0572 -
HMDB0001644 d-Xylulose C5H10O5 ESI - 1.6288 151.0607 -
HMDB0000127 d-Glucuronic acid C6H10O7 ESI - 3.6827 193.0474 +
HMDB0000177 Δl-histidine C6H9N3O2 ESI + 0.6353 156.0459 -
HMDB0062781 2-oxoglutarate C5H6O5 ESI - 0.8023 145.0105 +
HMDB0000156 Δl-Malic acid C4H6O5 ESI - 0.7309 133.0072 +
HMDB0000094 Δ Citrate C6H8O7 ESI + 0.9318 193.0375 +
HMDB0000068 Epinephrine C6H7N5O ESI + 2.3582 184.0994 -
HMDB0000073 Δ Dopamine C8H11NO2 ESI + 0.8783 154.0985 +
HMDB0002052 Maleylacetoacetic acid C8H8O6 ESI + 2.8867 201.042 -
HMDB0000251 Δ Taurine C2H7NO3S ESI - 0.6159 124.0016 -
HMDB0000167 Δl-threonine C4H9NO3 ESI + 0.7366 120.0690 +
HMDB0000123 Δ Glycine C2H5NO2 ESI + 4.2937 76.0406 -
HMDB0000289 Uric acid C5H4N4O3 ESI + 1.0763 169.0381 -
HMDB0000034 Adenine C6H7N5 ESI + 0.9096 136.0654 -

Notes: Δ represents target metabolomics differential metabolites, and the rest are untargeted metabolomics differential metabolites. - indicates that MOG has a decreasing trend compared with SOG, + indicates that MOG showed an upward trend compared with SOG.