Table 2.
Metabolite | Chemical shifts (δ) | KEGG ID | RF model importance | p-value | Fold change (ulcer/control) |
---|---|---|---|---|---|
Choline | 3.195, 3.505, 4.055, 3.515 | C00114 | 0.0331 | 0.0172 | 3.28 ↓ |
Cis-aconitate | 3.095, 3.105 | C00417 | 0.0263 | 2.32E-05 | 2.05 ↓ |
Tryptophan | 3.285, 3.295, 3.465, 3.475 | C00078 | 0.0240 | 0.0066 | 3.79 ↓ |
Spermidine | 3.155, 3.145 | C00315 | 0.0194 | 0.0010 | 6.40 ↓ |
Trimethylamine | 3.255 | C00565 | 0.0190 | 0.0276 | 1.75 ↑ |
N,N-Dimethylglycine | 2.915, 3.705 | C01026 | 0.0190 | 0.0150 | 2.50 ↓ |
Acetylcarnitine | 3.175, 3.605, 3.185, 3.595 | C02571 | 0.0138 | 0.0184 | 1.90 ↓ |
Creatinine | 4.045 | C00791 | 0.0138 | 0.0157 | 6.60 ↓ |
Pantothenate | 3.425 | C00864 | 0.0135 | 0.0085 | 3.52 ↓ |
Betaine | 3.265 | C00719 | 0.0125 | 0.0490 | 1.60 ↓ |
Taurine | 3.405, 3.415, 3.395, 3.385 | C00245 | 0.0125 | 0.0010 | 7.90 ↓ |
Carnitine | 3.205, 3.215 | C00318 | 0.0123 | 0.0128 | 1.80 ↑ |
Isoleucine | 3.655, 3.665 | C00407 | 0.0121 | 0.0061 | 5.05 ↓ |
Glucose | 3.455, 3.235, 3.525, 3.725, 3.825 | C00031 | 0.0119 | 0.0010 | 3.88 ↓ |
Kynurenine | 3.695 | C00328 | 0.0114 | 0.0113 | 5.50 ↓ |
Methionine | 2.115, 3.855 | C00073 | 0.0110 | 0.0447 | 2.18 ↓ |
Acetylcholine | 3.205 | C01996 | 0.0057 | 0.0285 | 2.00 ↑ |