TABLE 2.
Compounds | RT | VIP | Fold change (patients/control) | Main metabolic pathway |
---|---|---|---|---|
1-methylinosine | 46.201 | 1.702 | 0.587a,d | Unknown |
2,6-dihydroxybenzoic acid methyl ester | 27.459 | 1.512 | 0.737a,d | Unknown |
2-hydroxy-2-methylbutanoic acid | 10.09 | 1.677 | 0.652a,d | Unknown |
2-hydroxyhippuric acid | 31.964 | 2.204 | 0.520a,c | Unknown |
3,4-dihydroxybutanoic acid | 18.321 | 2.702 | 0.331b | Unknown |
4-hydroxybenzoic acid | 22.986 | 2.626 | 0.448a,c | Phenylalanine metabolism |
5-hydroxyindole | 24.691 | 2.149 | 0.491a,c | Tryptophan metabolism |
Creatinine√ | 21.177 | 2.131 | 0.521a,c | Arginine and proline metabolism |
D-glycero-D-gulo-heptose | 37.389 | 1.595 | 0.690a,c | Unknown |
d-mannitol√ | 29.345 | 1.789 | 5.404a,c | Fructose and mannose metabolism |
Homovanillic acid | 26.142 | 1.666 | 0.700a,c | Tyrosine metabolism |
Hypoxanthine√ | 26.825 | 1.647 | 0.524a,c | Purine metabolism |
Isocitric acid | 27.218 | 2.324 | 0.430a,c | Tricarboxylic acid (TCA) cycle |
l-threonic acidb | 21.022 | 1.563 | 0.710a,c | Unknown |
Meso-erythritol√ | 20.168 | 1.939 | 0.553a,c | Unknown |
Methylcitric acid | 27.483 | 1.686 | 0.667a,c | Unknown |
Oxalic acid√ | 10.164 | 2.416 | 0.574a,c | Glyoxylate and dicarboxylate metabolism |
Phenylalanine | 22.88 | 1.575 | 0.223b | Phenylalanine metabolism |
p-hydroxyphenylacetic acid | 23.253 | 1.691 | 0.631b | Phenylalanine metabolism |
Pseudo uridineb | 36.746 | 1.757 | 0.596a,c | Pyrimidine metabolism |
Sugar (37.638) | 37.638 | 1.83 | 0.559a,c | Starch and sucrose metabolism |
Uracil√ | 15.787 | 1.679 | 0.415a,c | Pyrimidine metabolism |
Vanillylmandelic acid | 28.385 | 1.616 | 0.694a,c | Unknown |
a p < 0.01, b p < 0.05, cadjusted p < 0.01 and dadjusted p < 0.05.
√means the structure of metabolite has been validated by standard compound.