Data for ST003143
Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 |
---|---|---|---|---|---|---|
10-hydroxy-2-decenoic acid | 3.39 | 3.09 | 2.83 | 3.12 | 3.10 | |
10-Hydroxydecanoate | 3.60 | 3.54 | 3.54 | 3.61 | 3.49 | |
10-undecanoate | 3.34 | 3.32 | 3.17 | 3.26 | 3.31 | |
1-Aminocyclopropanecarboxylate | 3.76 | 3.80 | 3.72 | 3.73 | 3.84 | |
1-Methylhistidine | 4.41 | 4.19 | 3.96 | 4.26 | 4.34 | |
2,3-Dihydroxybenzoate | 3.36 | 3.17 | 3.35 | 3.14 | 3.06 | |
2^,4^-Dihydroxyacetophenone | 3.41 | 3.18 | 3.18 | 3.33 | 3.17 | |
2,4-Dihydroxypteridine | 3.41 | 3.19 | 3.02 | 3.25 | 3.52 | |
2,5-Dihydroxybenzoate | 3.43 | 3.04 | 2.96 | 3.00 | 2.96 | |
2-Aminooctanoate | 3.26 | 2.79 | 3.09 | 3.13 | 2.81 | |
2-Aminophenol | 2.82 | 2.74 | 2.84 | 2.73 | 2.68 | |
2-Ethyl-2-hydroxybutanoate | 4.25 | 3.80 | 3.95 | 3.84 | 3.78 | |
2-Hydroxy-4-(methylthio)butanoate | 3.69 | 3.54 | 3.47 | 3.39 | 3.40 | |
2-Hydroxybutyrate | 5.70 | 5.91 | 5.88 | 5.82 | 6.06 | |
2-Hydroxyglutarate | 4.95 | 5.47 | 5.10 | 5.23 | 5.27 | |
2-Hydroxyhexadecanoate | 3.66 | 3.88 | 3.52 | 3.79 | 3.69 | |
2-Hydroxypyridine | 3.54 | 3.59 | 3.47 | 3.52 | 3.53 | |
2-Hydroxytetradecanoate | 2.97 | 3.19 | 2.97 | 3.09 | 3.13 | |
2-Isopropylmalate | 4.19 | 3.66 | 3.37 | 3.67 | 3.35 | |
2-Ketohexanoic | 3.93 | 3.73 | 3.83 | 3.92 | 3.77 | |
2-Octenoylcarnitine | 5.04 | 5.07 | 6.09 | 5.36 | 5.23 | |
2-Propenoate | 2.69 | 2.57 | 2.00 | 2.65 | 2.53 | |
2-Quinolinecarboxylate | 2.99 | 2.46 | 2.38 | 2.49 | 2.46 | |
3-(2-Hydroxyphenyl)propanoate | 4.28 | 4.21 | 3.91 | 4.28 | 3.95 | |
3-(3,4,5-Trimethoxyphenyl)propionate | 3.72 | 3.52 | 3.35 | 3.60 | 3.54 | |
3,3-Dimethylglutarate | 4.59 | 3.96 | 4.01 | 4.19 | 3.88 | |
3,4,5-Trimethoxycinnamate | 3.71 | 3.70 | 3.47 | 3.78 | 3.77 | |
3,4-Dihydroxybenzoate | 3.82 | 3.45 | 3.45 | 3.43 | 3.50 | |
3,4-Dihydroxyphenylacetate | 3.76 | 3.34 | 3.08 | 3.37 | 3.43 | |
3,4-Dihydroxyphenylglycol | 3.15 | 2.89 | 2.36 | 3.00 | 3.08 | |
3-(4-Hydroxyphenyl)pyruvate | 4.62 | 4.51 | 4.34 | 4.68 | 4.41 | |
3-Dehydroshikimate | 4.36 | 4.34 | 4.29 | 4.31 | 4.39 | |
3-Hydroxyanthranilate | 3.31 | 3.23 | 3.03 | 3.26 | 3.06 | |
3-Hydroxybenzaldehyde | 3.81 | 3.52 | 3.28 | 3.73 | 3.52 | |
3-Hydroxybenzenemethanol | 3.26 | 2.89 | 3.26 | 3.16 | 2.96 | |
3-Hydroxydodecanoylcarnitine | 4.15 | 4.38 | 4.18 | 4.41 | 4.65 | |
3-Hydroxyhexadecanoylcarnitine | 3.49 | 3.81 | 3.55 | 3.63 | 4.09 | |
3-Hydroxymethylglutarate | 4.77 | 4.76 | 4.40 | 4.52 | 4.77 | |
3-Hydroxyoctanoate | 4.57 | 4.38 | 4.30 | 4.64 | 4.49 | |
3-Hydroxypyruvate | 4.10 | 4.13 | 3.93 | 4.09 | 4.01 | |
3-Hydroxysebacate | 4.29 | 3.45 | 3.68 | 3.56 | 3.29 | |
3-Methoxy-4-hydroxymandelate | 4.52 | 3.76 | 3.39 | 3.87 | 3.87 | |
3-Methoxytyrosine | 3.64 | 3.86 | 3.52 | 3.54 | 3.55 | |
3-Methyl-2-oxovalerate | 4.04 | 4.49 | 3.97 | 4.31 | 4.57 | |
3-Methyladenine | 4.55 | 4.19 | 3.98 | 4.40 | 4.12 | |
3-Methylglutarylcarnitine | 3.54 | 3.50 | 5.02 | 3.89 | 3.68 | |
3-Methylhistamine | 3.42 | 3.45 | 4.05 | 3.64 | 3.71 | |
3-Nitrotyrosine | 2.88 | 2.80 | 2.52 | 2.76 | 2.82 | |
3-Sulfinoalanine | 4.31 | 4.61 | 4.27 | 4.30 | 4.39 | |
4-Acetamidobutanoate | 4.35 | 3.88 | 3.58 | 4.05 | 3.82 | |
4-Acetylbutyrate | 3.82 | 3.58 | 3.65 | 3.87 | 3.57 | |
4-Coumarate | 3.50 | 3.29 | 3.07 | 3.21 | 3.37 | |
4-Guanidinobutanoate | 3.74 | 3.81 | 4.26 | 3.52 | 4.08 | |
4-Hydroxybenzaldehyde | 4.59 | 4.50 | 4.33 | 4.67 | 4.39 | |
4-Hydroxybenzoate | 4.27 | 3.91 | 3.77 | 3.93 | 3.87 | |
4-Hydroxyphenyl-2-propionate | 4.27 | 4.20 | 3.91 | 4.27 | 3.95 | |
4-Hydroxyphenylglycine | 3.94 | 4.21 | 4.02 | 4.01 | 3.77 | |
4-Imidazoleacetate | 3.26 | 3.11 | 3.26 | 3.13 | 3.18 | |
4-Methoxybenzeneacetate | 3.17 | 3.08 | 2.90 | 3.17 | 3.11 | |
4-Methylcatechol | 3.04 | 2.84 | 2.48 | 2.76 | 3.04 | |
4-Pyridoxate | 5.16 | 4.35 | 3.75 | 4.59 | 4.22 | |
5-Aminolevulinate | 3.97 | 3.97 | 3.87 | 3.98 | 3.98 | |
5-Aminopentanoate | 6.18 | 6.20 | 6.02 | 6.16 | 6.29 | |
5-Deoxyadenosine | 3.23 | 3.42 | 3.16 | 3.39 | 3.37 | |
5-Hydroxylysine | 3.30 | 3.06 | 2.88 | 3.04 | 3.04 | |
5-Hydroxytryptophan | 4.30 | 4.43 | 4.46 | 4.46 | 4.37 | |
5-Methoxytryptophan | 3.15 | 3.40 | 2.73 | 3.01 | 3.14 | |
5-Methylcytosine | 3.96 | 3.57 | 3.69 | 3.83 | 3.57 | |
5-Valerolactone | 2.82 | 2.77 | 2.54 | 2.78 | 3.00 | |
6-Carboxyhexanoate | 4.59 | 3.96 | 4.03 | 4.20 | 3.89 | |
6-Hydroxydopamine | 3.34 | 3.24 | 3.15 | 3.38 | 3.18 | |
6-Hydroxynicotinate | 3.25 | 3.18 | 3.12 | 3.08 | 2.96 | |
6-Phosphogluconate | 4.36 | 5.06 | 5.40 | 5.22 | 5.12 | |
6-Phosphonogluconolactone | 3.84 | 4.46 | 4.74 | 4.60 | 4.60 | |
7alpha-Hydroxy-3-oxo-4-cholestenoate | 2.97 | 3.88 | 3.02 | 2.98 | 3.63 | |
7-Hydroxyoctanoate | 3.70 | 3.86 | 4.04 | 3.91 | 3.90 | |
9-Decenoylcarnitine | 4.48 | 4.67 | 4.44 | 4.62 | 4.59 | |
Acetoacetate | 4.32 | 4.41 | 4.30 | 4.58 | 4.44 | |
Acetoin | 3.93 | 4.20 | 4.01 | 3.86 | 4.00 | |
Acetylcarnitine | 6.83 | 7.07 | 7.10 | 6.94 | 7.17 | |
Adenine | 5.61 | 5.57 | 5.91 | 5.64 | 5.67 | |
Adenosine | 6.42 | 6.24 | 6.60 | 6.49 | 6.34 | |
Adenosine monophosphate | 6.69 | 6.79 | 7.36 | 6.81 | 6.91 | |
Adipate | 4.95 | 4.44 | 4.44 | 4.55 | 4.26 | |
ADP-glucose | 3.64 | 3.44 | 2.70 | 3.71 | 3.61 | |
Agmatine sulfate | 2.59 | 2.56 | 2.57 | 2.49 | 2.52 | |
Aicar | 4.31 | 4.27 | 4.14 | 4.13 | 4.25 | |
Alanine | 4.91 | 4.91 | 5.00 | 5.05 | 4.97 | |
Allantoin | 3.54 | 3.58 | 2.98 | 3.90 | 3.74 | |
alpha-Ketoisovalerate | 4.31 | 4.64 | 4.14 | 4.30 | 4.53 | |
Aminoadipate | 4.76 | 5.18 | 5.59 | 4.97 | 5.01 | |
Anserine | 3.76 | 3.16 | 3.22 | 3.54 | 3.27 | |
Arabitol | 3.70 | 3.45 | 3.20 | 3.51 | 3.33 | |
Arginine | 5.37 | 5.37 | 5.47 | 5.35 | 5.39 | |
Argininosuccinate | 2.86 | 2.86 | 3.50 | 2.99 | 2.96 | |
Ascorbate | 4.07 | 3.84 | 3.59 | 3.91 | 3.82 | |
Asparagine | 4.70 | 4.66 | 4.68 | 4.80 | 4.73 | |
Aspartate | 5.61 | 5.59 | 5.79 | 5.74 | 5.57 | |
Azelate | 4.93 | 4.61 | 4.77 | 4.86 | 4.51 | |
Benzaldehyde | 2.60 | 2.74 | 2.75 | 2.47 | 2.75 | |
Benzoate | 4.50 | 4.26 | 4.88 | 4.42 | 4.09 | |
Benzylamine | 3.92 | 3.95 | 3.95 | 4.01 | 4.06 | |
Betaine | 6.76 | 6.77 | 6.66 | 6.83 | 6.92 | |
Betaine aldehyde | 4.32 | 4.45 | 4.58 | 4.40 | 4.52 | |
Biliverdin | 3.22 | 3.80 | 2.89 | 3.07 | 3.87 | |
Biotin | 3.33 | 3.19 | 3.34 | 3.12 | 3.21 | |
Bis(2-ethylhexyl)phthalate | 4.05 | 4.00 | 3.98 | 4.21 | 4.17 | |
Butanoate | 4.61 | 4.30 | 4.33 | 4.22 | 4.10 | |
Caffeate | 4.03 | 3.21 | 3.09 | 3.19 | 3.21 | |
Caffeine | 4.62 | 4.36 | 4.49 | 4.15 | 4.46 | |
Carnitine | 6.75 | 6.94 | 7.12 | 6.84 | 7.03 | |
Carnitine (12:0) | 4.78 | 4.99 | 4.65 | 4.85 | 5.06 | |
Carnitine (14:0) | 4.33 | 4.76 | 4.63 | 4.45 | 4.81 | |
Carnitine (16:0) | 4.74 | 5.25 | 5.66 | 4.93 | 5.45 | |
Carnitine (18:1) | 5.06 | 5.75 | 5.79 | 5.19 | 5.77 | |
Carnitine (3:0) | 5.80 | 5.61 | 5.57 | 5.58 | 6.12 | |
Carnitine (4:0) | 6.59 | 6.43 | 6.69 | 6.39 | 6.48 | |
Carnitine (6:0) | 5.60 | 5.12 | 5.05 | 5.31 | 5.22 | |
Carnitine (8:0) | 4.76 | 4.75 | 4.46 | 4.85 | 4.72 | |
Carnitine (glutaryl) | 5.18 | 4.60 | 5.01 | 4.76 | 4.61 | |
Carnosine | 3.98 | 3.42 | 3.51 | 3.77 | 3.31 | |
CDP-ethanolamine | 5.53 | 5.61 | 5.83 | 5.63 | 5.42 | |
Cholate | 3.26 | 3.18 | 2.95 | 2.81 | 3.08 | |
cis-4-Hydroxyproline | 3.79 | 3.76 | 3.74 | 3.87 | 3.82 | |
cis-Aconitate | 4.59 | 4.91 | 4.57 | 4.72 | 4.77 | |
Citicoline | 4.23 | 4.38 | 4.53 | 4.47 | 4.27 | |
Citramalate | 5.16 | 4.57 | 4.17 | 4.68 | 4.27 | |
Citrate | 6.81 | 7.29 | 7.04 | 6.93 | 7.20 | |
Citrulline | 3.72 | 4.16 | 4.33 | 3.99 | 4.20 | |
Cortexolone | 3.20 | 3.04 | 2.84 | 3.09 | 3.03 | |
Cortisone | 3.51 | 2.98 | 3.15 | 3.00 | 3.06 | |
Creatine | 6.85 | 7.03 | 6.86 | 6.93 | 6.67 | |
Creatinine | 6.63 | 6.46 | 6.26 | 6.54 | 6.17 | |
Cyclic ADP-ribose | 6.24 | 6.09 | 6.74 | 6.29 | 6.02 | |
Cyclic AMP | 4.36 | 4.66 | 4.48 | 4.54 | 4.35 | |
Cystathionine | 4.50 | 4.97 | 5.08 | 5.17 | 5.11 | |
Cysteine | 3.54 | 3.15 | 2.98 | 3.12 | 3.15 | |
Cystine | 4.53 | 3.96 | 3.85 | 3.98 | 3.92 | |
Cytidine | 5.96 | 6.06 | 6.53 | 6.33 | 6.05 | |
Cytidine cyclic phosphate | 4.04 | 4.11 | 3.91 | 4.05 | 4.26 | |
Cytidine diphosphate | 3.98 | 3.53 | 3.13 | 3.48 | 3.53 | |
Cytidine monophosphate | 5.47 | 5.83 | 6.03 | 5.71 | 5.76 | |
Cytosine | 4.71 | 4.77 | 5.00 | 4.78 | 4.81 | |
Decadienoylcarnitine | 3.63 | 3.62 | 3.92 | 3.69 | 3.68 | |
Decanoylcarnitine | 4.89 | 5.06 | 4.70 | 5.02 | 5.05 | |
Deoxyadenosine | 2.99 | 3.18 | 2.78 | 3.02 | 2.92 | |
Deoxyadenosine monophosphate | 3.50 | 3.78 | 3.91 | 3.56 | 3.80 | |
Deoxycarnitine | 5.84 | 6.03 | 6.28 | 5.85 | 6.20 | |
Deoxycholate | 3.12 | 3.44 | 2.53 | 3.01 | 3.34 | |
Deoxycytidine | 3.20 | 3.17 | 3.07 | 3.29 | 3.22 | |
Deoxycytidine monophosphate | 3.98 | 4.23 | 3.86 | 4.17 | 4.46 | |
Deoxyguanosine | 3.42 | 3.51 | 3.33 | 3.32 | 3.18 | |
Deoxyguanosine monophosphate | 7.05 | 7.09 | 7.09 | 7.10 | 7.27 | |
Deoxyinosine | 3.33 | 3.41 | 3.27 | 3.11 | 3.03 | |
Deoxyribose | 2.79 | 2.81 | 2.85 | 2.77 | 2.79 | |
Deoxyuridine | 4.34 | 3.91 | 3.37 | 4.01 | 3.73 | |
Deoxyuridine monophosphate | 3.36 | 3.23 | 2.97 | 3.17 | 3.22 | |
Diacetyl | 3.38 | 3.36 | 3.33 | 3.43 | 3.41 | |
Diaminopimelate | 4.27 | 4.30 | 3.80 | 3.89 | 3.92 | |
Diethanolamine | 2.55 | 2.57 | 1.85 | 2.47 | 2.62 | |
Dihydrouracil | 3.53 | 3.64 | 3.32 | 3.65 | 3.56 | |
Dimethylglycine | 4.14 | 4.08 | 4.25 | 4.12 | 4.11 | |
Docosahexaenoate | 3.24 | 3.49 | 3.03 | 3.19 | 3.31 | |
Dopamine | 3.49 | 3.78 | 3.76 | 3.57 | 3.54 | |
Eicosapentaenoate | 2.48 | 2.75 | 2.71 | 2.38 | 2.63 | |
Erythrose 4-phosphate | 3.71 | 3.76 | 3.54 | 3.70 | 3.86 | |
Ethylmalonate | 3.87 | 3.71 | 3.54 | 3.64 | 3.49 | |
FA (16:0) | 3.17 | 3.48 | 3.36 | 3.29 | 3.20 | |
FA (18:1) | 3.02 | 3.69 | 3.55 | 3.14 | 3.34 | |
FAD | 5.74 | 5.03 | 5.29 | 5.22 | 4.92 | |
Ferulate | 3.36 | 3.11 | 3.16 | 3.22 | 3.18 | |
Folate | 3.29 | 3.14 | 3.13 | 3.23 | 3.42 | |
Fructose 1,6-bisphophate | 5.50 | 6.18 | 6.79 | 6.20 | 6.09 | |
Fructose 6-phosphate | 4.81 | 5.21 | 5.52 | 5.14 | 4.90 | |
Fumarate | 4.98 | 4.61 | 4.31 | 4.59 | 4.81 | |
Gamma-linoleonate | 1.96 | 2.49 | 2.02 | 2.01 | 2.34 | |
Gluconate | 7.48 | 7.14 | 6.97 | 7.27 | 6.92 | |
Gluconolactone | 3.96 | 3.68 | 3.36 | 3.84 | 3.40 | |
Glucosamine 6-phosphate | 4.28 | 4.37 | 4.40 | 4.17 | 4.52 | |
Glucosamine 6-sulfate | 3.81 | 3.89 | 3.88 | 3.72 | 4.13 | |
Glucuronate | 4.98 | 4.38 | 4.22 | 4.63 | 4.06 | |
Glucuronolactone | 2.80 | 3.23 | 3.49 | 3.29 | 3.33 | |
Glutamate | 6.76 | 6.91 | 7.00 | 6.90 | 7.00 | |
Glutamine | 5.37 | 5.76 | 5.92 | 5.83 | 5.88 | |
Glutarate | 4.51 | 4.78 | 4.68 | 4.49 | 4.56 | |
Glutathione | 3.84 | 5.09 | 5.94 | 5.28 | 5.10 | |
Glutathione disulfide | 5.10 | 7.20 | 7.74 | 7.34 | 7.50 | |
Glyceraldehyde 3-phosphate | 4.49 | 4.85 | 4.91 | 4.85 | 4.83 | |
Glycerate | 4.51 | 4.82 | 4.45 | 4.57 | 4.57 | |
Glycerol 3-phosphate | 5.53 | 5.17 | 5.38 | 5.14 | 5.18 | |
Glycerophosphocholine | 6.43 | 6.45 | 7.10 | 6.67 | 6.60 | |
Glycine | 3.21 | 3.27 | 2.96 | 3.26 | 3.27 | |
Glycochenodeoxycholate | 4.04 | 4.55 | 3.65 | 4.12 | 4.09 | |
Glycocholate | 4.51 | 4.42 | 3.50 | 4.38 | 4.05 | |
Glycodeoxycholate | 3.84 | 4.14 | 3.15 | 3.74 | 3.87 | |
Glycolate | 3.98 | 4.04 | 3.81 | 4.01 | 3.99 | |
Glycolithocholate | 2.53 | 2.96 | 1.87 | 2.33 | 2.82 | |
Glycoursodeoxycholate | 3.39 | 3.57 | 3.24 | 3.46 | 3.69 | |
Glyoxylate | 3.25 | 2.98 | 2.83 | 3.07 | 3.01 | |
Guanidinoacetate | 5.22 | 4.66 | 5.32 | 4.76 | 4.74 | |
Guanidinosuccinate | 3.92 | 3.25 | 2.98 | 3.57 | 3.17 | |
Guanine | 5.47 | 5.48 | 5.79 | 5.34 | 5.52 | |
Guanosine | 5.56 | 5.74 | 5.76 | 5.41 | 5.10 | |
Guanosine monophosphate | 6.53 | 6.51 | 6.74 | 6.33 | 6.55 | |
Gulonolactone | 4.54 | 4.28 | 4.13 | 4.45 | 4.05 | |
Heptadecanoate | 2.27 | 2.44 | 2.42 | 2.28 | 2.43 | |
Hexosamines | 2.72 | 2.84 | 2.82 | 2.80 | 2.83 | |
Hexose | 4.78 | 4.41 | 3.80 | 4.83 | 4.20 | |
Hippurate | 6.71 | 5.43 | 4.38 | 5.58 | 5.22 | |
Histamine | 5.00 | 5.34 | 5.94 | 5.29 | 5.40 | |
Histidine | 4.65 | 4.51 | 4.49 | 4.57 | 4.63 | |
Homocysteine | 2.97 | 3.03 | 3.25 | 2.89 | 2.99 | |
Homogentisate | 4.05 | 3.51 | 3.36 | 3.56 | 3.56 | |
Homoserine | 4.45 | 4.38 | 4.15 | 4.43 | 4.49 | |
Hydroquinone | 3.40 | 3.16 | 3.19 | 3.07 | 3.16 | |
Hydroxy-FA (12:0) | 3.50 | 3.55 | 3.38 | 3.56 | 3.43 | |
Hydroxy-isocaproate | 4.61 | 4.53 | 4.83 | 4.64 | 4.56 | |
Hydroxykynurenine | 3.37 | 3.00 | 2.66 | 2.85 | 2.78 | |
Hydroxyphenyllactate | 5.10 | 4.86 | 4.81 | 4.84 | 4.62 | |
Hyocholate | 2.38 | 2.43 | 2.09 | 2.19 | 2.61 | |
Hypotaurine | 3.32 | 3.69 | 4.16 | 3.32 | 3.82 | |
Hypoxanthine | 7.13 | 6.77 | 6.85 | 6.89 | 6.85 | |
Indole-3-acetate | 3.01 | 2.72 | 2.63 | 2.76 | 2.82 | |
Indole-3-carboxylate | 3.37 | 2.86 | 2.66 | 3.15 | 2.88 | |
Indole-3-ethanol | 2.63 | 2.71 | 2.46 | 2.61 | 2.76 | |
Indoleacetaldehyde | 2.66 | 2.44 | 2.01 | 2.24 | 2.53 | |
Inosine | 7.27 | 7.20 | 7.14 | 7.07 | 6.88 | |
Isocitrate | 5.53 | 6.42 | 6.01 | 5.76 | 6.11 | |
Isoleucine | 6.69 | 6.63 | 6.46 | 6.58 | 6.63 | |
Isovalerylcarnitine | 5.95 | 5.13 | 5.13 | 5.27 | 5.10 | |
Itaconate | 3.71 | 3.71 | 3.69 | 3.66 | 3.73 | |
Ketoleucine | 4.34 | 4.80 | 4.21 | 4.68 | 4.96 | |
Kynurenine | 4.47 | 4.77 | 4.98 | 4.57 | 4.84 | |
Lactate | 7.34 | 7.39 | 7.30 | 7.33 | 7.33 | |
Lactose | 3.12 | 3.23 | 3.18 | 3.46 | 3.31 | |
Lactoylglutathione | 3.38 | 4.07 | 4.18 | 4.09 | 3.85 | |
L-DOPA | 3.99 | 4.57 | 4.65 | 4.15 | 4.31 | |
Leucine | 6.69 | 6.62 | 6.46 | 6.58 | 6.62 | |
Linoleate | 2.93 | 3.55 | 3.44 | 3.11 | 3.29 | |
Lithocholate | 2.00 | 2.03 | 1.48 | 1.67 | 2.32 | |
Lumichrome | 3.92 | 3.29 | 3.38 | 3.53 | 3.30 | |
Lysine | 4.98 | 5.02 | 4.99 | 4.95 | 4.95 | |
Lyso-PC (16:0) | 5.20 | 5.62 | 5.19 | 5.49 | 5.66 | |
Lyso-PC (18:1) | 4.97 | 5.43 | 4.71 | 5.12 | 5.35 | |
Lyso-PE (16:0) | 3.92 | 3.57 | 3.44 | 3.69 | 3.71 | |
Lyso-PE (18:1) | 4.05 | 3.87 | 3.69 | 3.81 | 3.90 | |
Malate | 6.74 | 6.75 | 6.69 | 6.69 | 6.81 | |
Maleate | 3.56 | 3.45 | 3.32 | 3.37 | 3.50 | |
Maleimide | 3.88 | 3.48 | 3.27 | 3.53 | 3.57 | |
Malonate | 3.62 | 3.68 | 3.47 | 3.71 | 3.55 | |
Mannitol | 4.24 | 4.41 | 4.79 | 4.35 | 4.21 | |
Mesaconate | 3.65 | 3.71 | 3.67 | 3.71 | 3.63 | |
Methionine | 5.35 | 5.20 | 4.97 | 5.11 | 5.17 | |
Methionine sulfoxide | 3.66 | 3.50 | 3.18 | 3.65 | 3.59 | |
Methyl jasmonate | 2.87 | 2.80 | 2.68 | 2.76 | 2.99 | |
Mevalolactone | 3.00 | 2.99 | 2.82 | 3.07 | 3.01 | |
Mevalonate | 3.82 | 3.52 | 3.26 | 3.41 | 3.40 | |
Murideoxycholate | 2.20 | 2.49 | 2.57 | 2.46 | 2.73 | |
N1-Acetylspermine | 2.87 | 3.25 | 3.37 | 3.25 | 3.13 | |
N-Acetylalanine | 4.29 | 4.60 | 4.25 | 4.33 | 4.82 | |
N-Acetylarginine | 4.72 | 4.71 | 4.61 | 4.59 | 4.86 | |
N-Acetylasparagine | 3.94 | 4.40 | 4.12 | 4.25 | 4.63 | |
N-Acetylaspartate | 6.89 | 5.65 | 5.71 | 5.76 | 5.30 | |
N-Acetylaspartylglutamate | 4.54 | 3.58 | 3.45 | 3.85 | 3.55 | |
N-Acetylcysteine | 3.65 | 3.62 | 3.31 | 3.67 | 3.42 | |
N-Acetylglucosamine | 3.97 | 3.86 | 3.61 | 3.71 | 3.75 | |
N-Acetylglutamate | 5.49 | 5.02 | 4.92 | 5.02 | 4.91 | |
N-Acetylglycine | 3.56 | 3.60 | 3.31 | 3.54 | 3.70 | |
N-Acetylleucine | 4.14 | 4.31 | 4.41 | 4.37 | 4.57 | |
N-Acetylmethionine | 4.26 | 4.16 | 4.34 | 3.89 | 3.95 | |
N-Acetylneuraminate | 5.81 | 6.40 | 7.05 | 6.43 | 6.66 | |
N-Acetylornithine | 3.54 | 3.55 | 3.15 | 3.24 | 3.40 | |
N-Acetylphenylalanine | 4.14 | 4.06 | 3.45 | 4.26 | 4.10 | |
N-Acetylproline | 3.31 | 3.23 | 3.17 | 3.36 | 3.31 | |
N-Acetylputrescine | 3.96 | 3.63 | 3.38 | 3.81 | 3.39 | |
N-Acetyltryptophan | 5.37 | 4.81 | 3.65 | 4.81 | 4.47 | |
NAD+ | 6.19 | 5.91 | 6.56 | 5.97 | 5.99 | |
NADPH | 3.15 | 3.08 | 2.99 | 3.12 | 3.35 | |
N-alpha-Acetyllysine | 4.77 | 4.69 | 4.04 | 4.53 | 4.63 | |
N-Formylglycine | 3.39 | 3.52 | 3.33 | 3.41 | 3.61 | |
N-Formylmethionine | 3.80 | 4.02 | 4.10 | 3.55 | 3.75 | |
Nicotinamide | 6.29 | 6.22 | 6.28 | 6.16 | 6.21 | |
Nicotinamide hypoxanthine dinucleotide | 4.58 | 4.95 | 5.18 | 4.57 | 5.03 | |
Nicotinamide mononucleotide | 4.44 | 4.40 | 4.47 | 4.35 | 4.45 | |
Nicotinate | 3.63 | 3.58 | 3.46 | 3.54 | 3.51 | |
N,N-Dimethylarginine | 5.21 | 5.01 | 4.97 | 5.05 | 4.91 | |
N,N,N-Trimethyllysine | 3.96 | 3.72 | 3.63 | 3.77 | 3.74 | |
Nor-Desoxycholate | 2.84 | 2.78 | 2.44 | 2.72 | 2.82 | |
O-Acetylserine | 6.13 | 6.26 | 6.47 | 6.22 | 6.30 | |
O-Adipoylcarnitine | 5.22 | 4.33 | 3.99 | 4.43 | 4.13 | |
Octopamine | 3.14 | 3.01 | 2.98 | 2.99 | 3.20 | |
O-Phosphoserine | 3.75 | 3.83 | 3.78 | 3.75 | 3.91 | |
Ophthalmate | 4.20 | 5.27 | 6.24 | 5.63 | 5.43 | |
Ornithine | 4.47 | 4.59 | 4.62 | 4.50 | 4.58 | |
Orotate | 3.78 | 3.76 | 3.77 | 3.74 | 3.82 | |
O-Succinylcarnitine | 4.94 | 4.91 | 5.48 | 4.97 | 5.04 | |
O-Succinyl homoserine | 3.36 | 3.47 | 3.75 | 3.46 | 3.60 | |
Oxoadipate | 3.70 | 3.77 | 3.62 | 3.75 | 3.81 | |
Oxoproline | 6.67 | 6.70 | 6.88 | 6.71 | 6.71 | |
Pantothenate | 6.22 | 5.75 | 5.29 | 5.76 | 5.70 | |
Phenethylamine | 4.49 | 4.35 | 4.33 | 4.45 | 4.26 | |
Phenylacetate | 3.32 | 3.12 | 2.88 | 3.07 | 3.18 | |
Phenylalanine | 6.56 | 6.59 | 6.38 | 6.51 | 6.50 | |
Phenylethanolamine | 3.13 | 3.08 | 2.82 | 2.88 | 2.92 | |
Phenyllactate | 4.27 | 4.20 | 3.91 | 4.27 | 3.94 | |
Phosphocreatine | 2.77 | 2.78 | 2.96 | 2.77 | 2.80 | |
Phosphoethanolamine | 5.66 | 5.54 | 5.39 | 5.56 | 5.56 | |
Phosphorylcholine | 6.15 | 6.02 | 6.52 | 6.27 | 6.23 | |
Phosphoserine | 4.03 | 4.18 | 3.95 | 4.21 | 4.27 | |
Pipecolate | 4.49 | 4.58 | 4.39 | 4.34 | 4.49 | |
Porphobilinogen | 2.73 | 2.77 | 2.56 | 2.74 | 2.67 | |
Proline | 6.26 | 6.30 | 6.22 | 6.18 | 6.30 | |
Propionylcholine | 4.56 | 4.49 | 4.46 | 4.40 | 4.60 | |
Pterin | 3.42 | 3.01 | 2.53 | 3.05 | 3.15 | |
Putrescine | 2.48 | 2.90 | 2.51 | 2.55 | 2.74 | |
Putrescine-NH3 | 3.06 | 3.35 | 3.18 | 3.27 | 3.36 | |
Pyridoxal | 3.99 | 4.13 | 3.85 | 3.91 | 4.10 | |
Pyridoxine | 3.95 | 3.85 | 3.75 | 3.80 | 3.77 | |
Pyrocatechol | 3.99 | 3.53 | 3.20 | 3.71 | 3.51 | |
Pyroglutamate | 6.67 | 6.70 | 6.88 | 6.70 | 6.71 | |
Pyruvate | 4.69 | 4.78 | 4.61 | 4.84 | 4.65 | |
Quinate | 4.93 | 4.73 | 3.88 | 5.17 | 4.69 | |
Raffinose | 3.42 | 3.64 | 3.64 | 4.17 | 4.00 | |
Ribitol | 2.53 | 2.46 | 2.55 | 2.38 | 2.40 | |
Riboflavin | 4.14 | 3.48 | 3.26 | 3.81 | 3.68 | |
Ribose 5-phosphate | 4.17 | 4.27 | 4.18 | 4.23 | 4.08 | |
Saccharate | 4.54 | 4.64 | 4.64 | 4.91 | 4.34 | |
S-adenosylhomocysteine | 5.28 | 5.12 | 4.75 | 5.04 | 4.92 | |
S-Adenosylmethionine | 4.19 | 4.23 | 4.56 | 4.16 | 4.28 | |
Salicylamide | 3.13 | 3.04 | 2.70 | 3.10 | 3.10 | |
Salsolinol | 3.72 | 3.98 | 4.08 | 3.78 | 3.82 | |
Sarcosine | 4.11 | 4.14 | 4.32 | 4.05 | 4.35 | |
S-Carboxymethylcysteine | 3.16 | 2.88 | 2.85 | 2.95 | 2.86 | |
Sebacate | 4.63 | 4.42 | 4.21 | 4.68 | 4.24 | |
Sedoheptulose 7-phosphate | 4.18 | 4.29 | 3.99 | 4.43 | 4.47 | |
Serine | 4.46 | 4.28 | 4.36 | 4.67 | 4.47 | |
Serotonin | 3.07 | 3.07 | 2.80 | 2.82 | 2.83 | |
S-Methylthioadenosine | 4.99 | 5.31 | 5.59 | 5.27 | 5.48 | |
Sorbate | 3.22 | 3.28 | 2.95 | 3.21 | 3.37 | |
Sorbitol | 2.79 | 2.84 | 3.16 | 2.79 | 2.76 | |
Spermidine | 5.22 | 5.61 | 5.54 | 5.46 | 5.56 | |
Spermine | 4.95 | 5.12 | 4.85 | 5.08 | 4.93 | |
Stachyose | 3.84 | 3.92 | 4.18 | 4.46 | 4.69 | |
Stearate | 3.17 | 3.35 | 3.25 | 3.25 | 3.32 | |
Stearoylcarnitine | 3.46 | 3.93 | 4.09 | 3.62 | 3.88 | |
Suberate | 4.59 | 4.27 | 4.35 | 4.39 | 4.12 | |
Succinate | 6.68 | 6.33 | 6.33 | 6.35 | 6.50 | |
Tartrate | 4.39 | 4.17 | 4.60 | 4.26 | 4.08 | |
Taurine | 6.99 | 6.99 | 7.07 | 6.97 | 7.03 | |
Tetrahydrobiopterin | 2.83 | 2.74 | 2.58 | 2.78 | 2.79 | |
Theobromine | 4.54 | 4.52 | 3.90 | 4.46 | 4.57 | |
Theophylline | 4.44 | 4.44 | 4.14 | 4.43 | 4.28 | |
Thiamine monophosphate | 3.13 | 3.09 | 2.92 | 2.86 | 2.97 | |
Threonine | 4.49 | 4.39 | 4.34 | 4.39 | 4.47 | |
Thymidine | 3.62 | 3.50 | 3.14 | 3.36 | 3.32 | |
Thymidine monophosphate | 4.86 | 5.11 | 5.49 | 4.87 | 4.89 | |
Thymine | 3.57 | 3.37 | 3.09 | 3.44 | 3.35 | |
Thyrotropin releasing hormone | 3.08 | 3.69 | 2.99 | 3.86 | 3.44 | |
Thyroxine | 2.63 | 2.93 | 2.59 | 2.50 | 2.77 | |
trans-2-Dodecenoylcarnitine | 4.46 | 4.69 | 4.43 | 4.70 | 4.75 | |
trans-2-Tetradecenoylcarnitine | 4.80 | 5.05 | 4.74 | 4.85 | 5.05 | |
trans-Aconitate | 4.28 | 4.35 | 4.45 | 4.29 | 4.24 | |
trans-trans-Mucanoate | 3.11 | 3.04 | 2.83 | 3.02 | 3.15 | |
Traumatate | 4.18 | 4.04 | 3.99 | 4.05 | 3.92 | |
Trigonelline | 5.70 | 5.12 | 5.06 | 5.38 | 5.02 | |
Trimethylamine | 3.63 | 3.57 | 3.37 | 3.68 | 3.62 | |
Tryptophan | 6.40 | 6.05 | 5.95 | 6.04 | 5.94 | |
Tyrosine | 6.13 | 5.95 | 5.62 | 5.89 | 6.07 | |
UDP-Glucose | 4.09 | 4.65 | 4.71 | 4.40 | 4.56 | |
UDP-N-acetylglucosamine | 4.70 | 5.30 | 5.19 | 5.04 | 4.94 | |
Undecanedionate | 4.12 | 4.11 | 3.88 | 4.13 | 4.18 | |
Uracil | 4.92 | 4.52 | 4.38 | 4.72 | 4.60 | |
Uracil 5-carboxylate | 3.74 | 3.72 | 3.87 | 3.82 | 3.69 | |
Urate | 7.06 | 6.95 | 6.80 | 6.90 | 7.15 | |
Ureidopropionate | 3.62 | 3.56 | 3.44 | 3.50 | 3.58 | |
Uridine | 6.12 | 5.99 | 5.51 | 5.94 | 5.80 | |
Uridine diphosphate | 4.35 | 4.52 | 4.42 | 4.76 | 4.44 | |
Uridine monophosphate | 5.08 | 4.51 | 4.42 | 4.51 | 4.03 | |
Urocanate | 4.33 | 4.13 | 4.07 | 4.33 | 4.23 | |
Ursocholate | 2.77 | 2.49 | 2.49 | 2.50 | 2.58 | |
Ursodeoxycholate | 2.23 | 2.50 | 2.57 | 2.47 | 2.75 | |
Valine | 4.72 | 4.65 | 4.39 | 4.65 | 4.71 | |
Xanthine | 6.75 | 6.32 | 6.17 | 6.55 | 6.50 | |
Xanthosine | 5.61 | 5.11 | 5.02 | 5.45 | 5.27 |
Factors:
F1 | Sample source:Adjacent_Kidney | Diagnosis:- |
F2 | Sample source:Primary_Tumour | Diagnosis:CCRCC |
F3 | Sample source:Primary_Tumour | Diagnosis:CHROMOPHOBE |
F4 | Sample source:Primary_Tumour | Diagnosis:ONCOCYTOMA |
F5 | Sample source:Primary_Tumour | Diagnosis:PAPILLARY |