Data for ST000976
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 |
|---|---|---|---|---|---|---|---|---|---|
| 10-heptadecenoate (17:1n7) | 0.85 | 1.12 | 0.57 | 3.77 | 1.39 | 1.39 | 1.03 | 1.86 | |
| 10-nonadecenoate (19:1n9) | 1.10 | 1.19 | 0.81 | 6.49 | 1.35 | 1.37 | 0.99 | 1.68 | |
| 10-undecenoate (11:1n1) | 0.92 | 0.71 | 1.04 | 1.89 | 1.13 | 1.70 | 0.79 | 0.89 | |
| 1-(14 or 15-methyl)palmitoyl-GPC (a17:0 or i17:0)* | 0.80 | 1.28 | 0.54 | 0.69 | 1.01 | 1.24 | 1.23 | 0.97 | |
| 1,2-propanediol | 1.03 | 1.51 | 0.86 | 6.48 | 1.85 | 0.96 | 1.50 | 0.98 | |
| 1,3,7-trimethylurate | 0.22 | 0.41 | 0.22 | 0.22 | 0.22 | 0.36 | 0.22 | 0.42 | |
| 1,3-dimethylurate | 0.81 | 0.81 | 0.81 | 0.81 | 0.81 | 0.93 | 0.81 | 0.85 | |
| 13-HODE + 9-HODE | 0.75 | 0.90 | 0.65 | 0.80 | 0.94 | 1.02 | 0.92 | 1.92 | |
| 13-methylmyristic acid | 1.08 | 1.22 | 1.00 | 1.52 | 1.10 | 1.10 | 1.03 | 0.95 | |
| 1,5-anhydroglucitol (1,5-AG) | 0.76 | 1.16 | 0.77 | 1.22 | 0.81 | 1.08 | 0.90 | 1.37 | |
| 15-methylpalmitate (isobar with 2-methylpalmitate) | 0.94 | 0.97 | 0.91 | 2.76 | 0.95 | 1.07 | 1.03 | 1.07 | |
| 16a-hydroxy DHEA 3-sulfate | 1.01 | 1.88 | 2.51 | 5.53 | 1.51 | 0.98 | 1.22 | 1.34 | |
| 16-hydroxypalmitate | 1.06 | 1.06 | 1.01 | 1.89 | 0.95 | 1.04 | 0.92 | 1.15 | |
| 1,7-dimethylurate | 0.19 | 0.24 | 0.19 | 0.68 | 0.19 | 0.48 | 0.19 | 0.69 | |
| 17-methylstearate | 1.11 | 0.95 | 0.83 | 2.88 | 1.06 | 1.02 | 1.05 | 1.09 | |
| 1-arachidonoylglycerophosphocholine (20:4n6)* | 0.61 | 0.92 | 1.02 | 1.04 | 0.67 | 1.18 | 1.02 | 1.21 | |
| 1-arachidonoylglycerophosphoethanolamine* | 0.60 | 1.04 | 0.78 | 1.40 | 0.90 | 1.14 | 0.98 | 1.21 | |
| 1-arachidonoylglycerophosphoinositol* | 0.86 | 0.87 | 1.19 | 1.88 | 0.88 | 1.26 | 0.81 | 1.59 | |
| 1-arachidonoylglyercophosphate | 0.90 | 0.65 | 1.89 | 1.15 | 0.95 | 1.08 | 1.25 | 1.10 | |
| 1-arachidoylglycerophosphocholine (20:0) | 1.17 | 1.38 | 0.97 | 1.03 | 0.64 | 1.07 | 1.33 | 1.16 | |
| 1-dihomo-linoleoylglycerophosphocholine (20:2n6)* | 0.63 | 1.33 | 0.76 | 1.40 | 0.61 | 1.01 | 1.33 | 1.42 | |
| 1-docosahexaenoylglycerophosphocholine (22:6n3)* | 0.62 | 0.97 | 1.12 | 0.90 | 0.94 | 1.19 | 1.65 | 1.17 | |
| 1-docosahexaenoylglycerophosphoethanolamine* | 0.59 | 1.10 | 1.14 | 1.35 | 1.14 | 1.15 | 1.33 | 1.33 | |
| 1-docosapentaenoylglycerophosphocholine (22:5n3)* | 0.46 | 1.00 | 0.63 | 1.01 | 0.76 | 1.16 | 1.17 | 1.25 | |
| 1-docosapentaenoylglycerophosphocholine (22:5n6)* | 0.32 | 0.86 | 0.55 | 1.11 | 0.48 | 1.43 | 1.15 | 1.34 | |
| 1-eicosapentaenoylglycerophosphocholine (20:5n3)* | 0.59 | 1.14 | 0.90 | 1.26 | 0.84 | 1.42 | 2.38 | 1.63 | |
| 1-eicosapentaenoylglycerophosphoethanolamine* | 0.40 | 1.88 | 0.51 | 1.56 | 1.02 | 1.16 | 2.06 | 2.76 | |
| 1-eicosatrienoylglycerophosphocholine (20:3)* | 0.60 | 1.22 | 0.50 | 1.31 | 0.57 | 1.19 | 1.00 | 1.15 | |
| 1-eicosatrienoylglycerophosphoethanolamine* | 0.56 | 0.96 | 0.91 | 1.52 | 0.88 | 0.97 | 1.12 | 1.39 | |
| 1-eicosenoylglycerophosphocholine (20:1n9)* | 0.73 | 1.32 | 1.05 | 1.44 | 0.52 | 1.16 | 1.32 | 1.46 | |
| 1-linolenoylglycerophosphocholine (18:3n3)* | 0.85 | 1.16 | 0.65 | 1.50 | 0.61 | 1.15 | 1.20 | 1.59 | |
| 1-linoleoylglycerol (1-monolinolein) | 1.54 | 0.98 | 0.08 | 0.56 | 2.96 | 1.60 | 1.12 | 7.20 | |
| 1-linoleoylglycerophosphocholine (18:2n6) | 0.72 | 1.11 | 0.73 | 1.04 | 0.74 | 1.11 | 1.45 | 1.35 | |
| 1-linoleoylglycerophosphoethanolamine* | 0.60 | 1.29 | 0.55 | 1.02 | 0.96 | 0.93 | 1.29 | 1.45 | |
| 1-linoleoylglycerophosphoinositol* | 0.74 | 1.44 | 1.34 | 4.12 | 0.67 | 0.82 | 0.87 | 1.80 | |
| 1-margaroylglycerophosphocholine (17:0) | 1.00 | 1.29 | 0.79 | 0.58 | 0.97 | 1.18 | 1.52 | 1.11 | |
| 1-methyl-2-piperidinecarboxylic acid | 0.90 | 1.41 | 0.64 | 0.82 | 0.69 | 1.21 | 1.17 | 1.82 | |
| 1-methylhistidine | 0.53 | 0.93 | 0.53 | 1.05 | 0.86 | 1.11 | 1.03 | 1.66 | |
| 1-methylurate | 0.23 | 1.03 | 0.45 | 3.82 | 0.31 | 1.03 | 0.27 | 4.20 | |
| 1-myristoylglycerophosphocholine (14:0) | 1.01 | 1.15 | 0.99 | 1.12 | 0.64 | 1.03 | 0.97 | 1.18 | |
| 1-nonadecanoylglycerophosphocholine(19:0) | 0.69 | 0.78 | 0.79 | 0.52 | 0.91 | 1.04 | 1.87 | 1.24 | |
| 1-oleoylglycerol (1-monoolein) | 0.70 | 1.09 | 0.22 | 0.59 | 1.46 | 1.26 | 1.41 | 1.74 | |
| 1-oleoylglycerophosphocholine (18:1)* | 0.55 | 1.29 | 0.74 | 1.58 | 0.69 | 1.03 | 1.03 | 1.16 | |
| 1-oleoylglycerophosphoethanolamine | 0.52 | 1.41 | 0.70 | 1.99 | 0.81 | 1.04 | 1.70 | 1.36 | |
| 1-oleoylglycerophosphoglycerol* | 0.64 | 1.18 | 0.81 | 2.11 | 0.64 | 0.79 | 0.75 | 0.86 | |
| 1-oleoylglycerophosphoinositol* | 0.58 | 2.26 | 0.27 | 3.89 | 0.89 | 1.01 | 1.07 | 0.94 | |
| 1-oleoylplasmenylethanolamine* | 1.17 | 1.16 | 1.16 | 0.98 | 1.28 | 1.13 | 1.35 | 0.95 | |
| 1-palmitoleoylglycerophosphocholine (16:1)* | 0.65 | 1.81 | 0.96 | 2.35 | 0.62 | 1.16 | 1.07 | 1.31 | |
| 1-palmitoylglycerol (1-monopalmitin) | 0.70 | 1.45 | 0.68 | 0.75 | 1.53 | 1.66 | 1.36 | 1.76 | |
| 1-palmitoylglycerophosphate | 0.93 | 0.80 | 1.04 | 1.01 | 1.01 | 1.08 | 1.56 | 1.10 | |
| 1-palmitoylglycerophosphocholine (16:0) | 0.69 | 1.19 | 1.01 | 1.04 | 0.72 | 1.00 | 1.07 | 1.08 | |
| 1-palmitoylglycerophosphoethanolamine | 0.62 | 1.11 | 1.23 | 1.00 | 0.87 | 0.94 | 1.26 | 1.40 | |
| 1-palmitoylglycerophosphoglycerol* | 0.68 | 0.65 | 1.31 | 0.87 | 0.76 | 0.78 | 0.63 | 1.36 | |
| 1-palmitoylglycerophosphoinositol* | 1.28 | 1.61 | 0.29 | 1.68 | 0.84 | 0.84 | 1.26 | 1.19 | |
| 1-palmitoylplasmenylethanolamine* | 0.88 | 0.96 | 1.30 | 0.96 | 0.96 | 1.00 | 1.11 | 1.10 | |
| 1-pentadecanoylglycerophosphocholine (15:0)* | 0.98 | 1.07 | 0.90 | 0.68 | 0.90 | 1.09 | 1.29 | 1.29 | |
| 1-ribosyl-imidazoleacetate* | 0.01 | 0.45 | 0.70 | 3.42 | 0.45 | 0.82 | 1.08 | 1.62 | |
| 1-stearoylglycerophosphocholine (18:0) | 0.90 | 1.03 | 0.98 | 0.77 | 0.81 | 0.96 | 1.06 | 1.04 | |
| 1-stearoylglycerophosphoethanolamine | 0.79 | 1.35 | 1.16 | 0.91 | 1.23 | 0.95 | 1.66 | 1.50 | |
| 1-stearoylglycerophosphoinositol | 0.78 | 1.14 | 0.97 | 1.68 | 0.92 | 1.00 | 1.12 | 1.16 | |
| 21-hydroxypregnenolone disulfate | 1.31 | 1.49 | 1.54 | 1.61 | 1.58 | 0.88 | 2.22 | 1.03 | |
| 2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)* | 0.93 | 0.93 | 1.40 | 1.10 | 0.78 | 1.31 | 0.63 | 2.19 | |
| 2-aminoadipate | 1.33 | 0.67 | 1.15 | 2.36 | 0.65 | 1.09 | 0.71 | 1.70 | |
| 2-aminobutyrate | 1.01 | 0.93 | 1.44 | 0.66 | 0.98 | 1.13 | 0.86 | 1.44 | |
| 2-aminoheptanoate | 1.20 | 1.02 | 1.99 | 1.11 | 1.35 | 1.04 | 0.90 | 1.19 | |
| 2-aminooctanoate | 0.65 | 0.97 | 0.31 | 1.23 | 1.46 | 1.71 | 0.90 | 1.96 | |
| 2-aminophenol sulfate | 0.39 | 0.39 | 0.88 | 1.99 | 0.42 | 0.62 | 0.47 | 0.94 | |
| 2-arachidonoylglycerophosphocholine* | 0.88 | 0.80 | 1.10 | 1.17 | 0.73 | 1.21 | 0.87 | 1.14 | |
| 2-arachidonoylglycerophosphoethanolamine* | 0.50 | 0.89 | 1.18 | 1.27 | 0.79 | 1.00 | 1.02 | 1.22 | |
| 2-docosahexaenoylglycerophosphocholine* | 0.94 | 0.69 | 1.44 | 1.00 | 1.07 | 1.20 | 1.41 | 1.06 | |
| 2-docosahexaenoylglycerophosphoethanolamine* | 0.52 | 1.00 | 1.21 | 1.17 | 1.14 | 1.09 | 1.37 | 1.05 | |
| 2-docosapentaenoylglycerophosphocholine (22:5n3)* | 0.59 | 0.72 | 0.88 | 0.84 | 1.02 | 0.96 | 1.11 | 1.37 | |
| 2-eicosatrienoylglycerophosphocholine* | 0.82 | 0.97 | 0.80 | 1.31 | 0.66 | 1.04 | 0.97 | 1.04 | |
| 2-ethylhexanoate | 0.87 | 1.00 | 1.08 | 1.10 | 0.96 | 0.99 | 0.99 | 1.01 | |
| 2-ethylphenylsulfate | 0.17 | 0.87 | 0.17 | 0.17 | 0.40 | 0.31 | 0.71 | 0.31 | |
| 2-hydroxy-3-methylvalerate | 0.74 | 0.86 | 1.35 | 4.59 | 0.78 | 1.34 | 0.86 | 1.40 | |
| 2-hydroxyacetaminophen sulfate* | 0.40 | 0.40 | 0.40 | 0.40 | 0.40 | 0.49 | 0.40 | 0.40 | |
| 2-hydroxybutyrate (AHB) | 1.15 | 1.79 | 1.53 | 2.99 | 0.82 | 1.15 | 0.98 | 1.68 | |
| 2-hydroxydecanoate | 1.00 | 0.71 | 0.89 | 0.71 | 1.40 | 1.31 | 1.42 | 1.59 | |
| 2-hydroxyglutarate | 1.14 | 1.63 | 0.99 | 1.13 | 0.84 | 0.97 | 0.79 | 1.28 | |
| 2-hydroxyhippurate (salicylurate) | 0.86 | 2.63 | 0.42 | 0.44 | 0.76 | 1.41 | 0.66 | 2.18 | |
| 2-hydroxyisobutyrate | 0.58 | 0.95 | 0.88 | 0.78 | 1.18 | 1.04 | 0.87 | 1.33 | |
| 2-hydroxyoctanoate | 0.63 | 0.89 | 0.27 | 0.79 | 1.07 | 1.09 | 1.06 | 1.51 | |
| 2-hydroxypalmitate | 1.05 | 0.97 | 1.00 | 1.27 | 0.91 | 1.02 | 0.93 | 1.21 | |
| 2-hydroxystearate | 0.96 | 0.97 | 1.11 | 0.93 | 0.97 | 1.01 | 1.01 | 1.23 | |
| 2-isopropylmalate | 0.23 | 1.02 | 1.33 | 0.30 | 1.02 | 0.98 | 1.38 | 1.01 | |
| 2-linolenoylglycerophosphocholine(18:3n3)* | 0.36 | 1.12 | 0.19 | 1.07 | 0.28 | 0.96 | 0.82 | 1.43 | |
| 2-linoleoylglycerophosphocholine* | 0.94 | 0.89 | 0.89 | 1.06 | 0.80 | 1.08 | 1.47 | 1.34 | |
| 2-linoleoylglycerophosphoethanolamine* | 0.50 | 1.55 | 0.64 | 1.18 | 0.92 | 0.94 | 1.51 | 1.67 | |
| 2-methoxyacetaminophen sulfate* | 0.52 | 0.52 | 0.52 | 0.52 | 0.52 | 0.58 | 0.52 | 0.65 | |
| 2-methylbutyrylcarnitine (C5) | 0.84 | 0.95 | 0.78 | 1.26 | 0.68 | 1.01 | 0.99 | 1.65 | |
| 2-myristoylglycerophosphocholine* | 0.76 | 1.17 | 0.93 | 1.17 | 0.41 | 0.91 | 0.94 | 1.10 | |
| 2-oleoylglycerol (2-monoolein) | 0.14 | 0.20 | 0.14 | 0.14 | 1.09 | 0.60 | 1.18 | 1.22 | |
| 2-oleoylglycerophosphocholine* | 0.54 | 1.26 | 0.94 | 1.91 | 0.64 | 1.06 | 1.16 | 1.18 | |
| 2-oleoylglycerophosphoethanolamine* | 0.56 | 1.52 | 0.57 | 1.89 | 0.89 | 1.06 | 1.82 | 1.36 | |
| 2^-O-methyluridine | 1.21 | 1.45 | 1.81 | 1.36 | 0.96 | 1.14 | 0.88 | 1.28 | |
| 2-oxoarginine* | 0.26 | 1.05 | 1.05 | 0.60 | 1.13 | 1.00 | 1.36 | 1.04 | |
| 2-palmitoleoylglycerophosphocholine* | 0.68 | 1.81 | 0.95 | 2.77 | 0.55 | 1.14 | 1.08 | 1.33 | |
| 2-palmitoylglycerophosphocholine* | 0.70 | 1.03 | 0.91 | 0.92 | 0.67 | 1.01 | 1.12 | 1.07 | |
| 2-palmitoylglycerophosphoethanolamine* | 0.71 | 1.20 | 1.15 | 1.00 | 0.97 | 0.92 | 1.30 | 1.52 | |
| 2-piperidinone | 0.90 | 4.67 | 2.12 | 1.03 | 0.80 | 1.38 | 0.93 | 1.28 | |
| 2-stearoylglycerophosphocholine* | 0.76 | 1.15 | 0.99 | 0.84 | 0.79 | 1.02 | 1.15 | 1.04 | |
| 2-stearoylglycerophosphoethanolamine* | 0.63 | 1.24 | 0.99 | 1.02 | 1.08 | 1.01 | 1.33 | 1.34 | |
| 3-[3-(sulfooxy)phenyl]propanoic acid* | 0.69 | 0.51 | 0.38 | 0.44 | 0.38 | 0.55 | 0.38 | 1.17 | |
| 3-(4-hydroxyphenyl)lactate | 1.05 | 1.05 | 1.16 | 1.58 | 0.63 | 1.10 | 0.79 | 1.42 | |
| 3,4-methylene heptanoyl carnitine | 2.91 | 0.82 | 1.37 | 0.38 | 1.18 | 1.08 | 0.92 | 1.90 | |
| 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) | 0.37 | 1.00 | 0.43 | 0.89 | 1.72 | 1.38 | 2.09 | 2.06 | |
| 3-CMPFP** | 0.84 | 0.64 | 0.55 | 0.50 | 1.62 | 1.69 | 0.97 | 1.94 | |
| 3-ethylphenylsulfate | 0.26 | 0.87 | 0.26 | 0.26 | 0.48 | 0.56 | 1.39 | 0.41 | |
| 3-formylindole | 0.72 | 1.18 | 0.81 | 0.98 | 0.86 | 1.11 | 0.90 | 1.14 | |
| 3-formylindole* | 0.66 | 1.37 | 0.79 | 1.37 | 1.13 | 1.11 | 0.89 | 1.02 | |
| 3-hydroxy-2-ethylpropionate | 0.46 | 1.25 | 0.95 | 1.90 | 0.58 | 1.04 | 0.83 | 1.52 | |
| 3-hydroxybutyrate (BHBA) | 0.73 | 1.90 | 1.16 | 11.21 | 6.15 | 1.26 | 0.93 | 1.68 | |
| 3-hydroxybutyroylglycine** | 0.12 | 4.70 | 1.19 | 9.44 | 0.65 | 0.80 | 0.23 | 0.12 | |
| 3-hydroxybutyrylcarnitine (2) | 0.20 | 0.92 | 0.20 | 6.00 | 0.27 | 0.48 | 0.20 | 0.82 | |
| 3-hydroxydecanoate | 1.32 | 0.93 | 0.69 | 2.66 | 1.54 | 1.47 | 0.92 | 1.07 | |
| 3-hydroxyhippurate | 0.54 | 1.74 | 0.32 | 1.97 | 0.32 | 1.40 | 0.81 | 1.05 | |
| 3-hydroxyisobutyrate | 1.32 | 1.16 | 1.60 | 1.45 | 0.71 | 1.05 | 1.06 | 1.52 | |
| 3-hydroxyoctanoate | 0.75 | 0.84 | 1.29 | 2.13 | 1.80 | 1.44 | 1.11 | 1.20 | |
| 3-hydroxypropanoate | 1.17 | 1.24 | 0.96 | 1.43 | 0.98 | 0.99 | 0.97 | 0.97 | |
| 3-indoxyl sulfate | 1.06 | 1.21 | 2.49 | 0.76 | 0.76 | 1.12 | 1.07 | 1.38 | |
| 3-methoxytyramine sulfate | 0.31 | 0.59 | 0.31 | 0.31 | 0.33 | 0.36 | 1.43 | 0.40 | |
| 3-methoxytyrosine | 0.89 | 0.92 | 0.51 | 1.29 | 1.01 | 1.10 | 1.20 | 1.29 | |
| 3-methyl-2-oxobutyrate | 1.02 | 1.10 | 1.11 | 1.12 | 0.83 | 1.02 | 0.98 | 1.25 | |
| 3-methyl-2-oxovalerate | 1.01 | 1.03 | 1.34 | 1.31 | 0.78 | 1.07 | 1.11 | 1.33 | |
| 3-methyl catechol sulfate (1) | 0.13 | 0.87 | 0.06 | 1.73 | 0.78 | 1.00 | 6.36 | 4.00 | |
| 3-methylglutarylcarnitine (1) | 0.29 | 0.45 | 1.90 | 1.09 | 0.47 | 0.75 | 0.65 | 2.40 | |
| 3-methylhistidine | 1.63 | 6.12 | 0.53 | 0.85 | 15.35 | 2.22 | 0.52 | 1.21 | |
| 3-(N-acetyl-L-cystein-S-yl) acetaminophen | 0.79 | 0.79 | 0.79 | 0.79 | 0.83 | 0.80 | 0.79 | 0.86 | |
| 3-phenylpropionate (hydrocinnamate) | 1.58 | 0.99 | 1.11 | 0.60 | 0.68 | 1.35 | 1.49 | 1.08 | |
| 3-S-cysteinyl-2-methylpropanoate* | 0.30 | 0.71 | 0.30 | 2.18 | 0.33 | 1.24 | 0.36 | 1.00 | |
| 3-ureidopropionate | 0.27 | 1.66 | 3.34 | 2.49 | 0.83 | 0.88 | 0.89 | 1.23 | |
| 4-acetamidobutanoate | 1.10 | 1.21 | 0.39 | 0.44 | 1.19 | 0.72 | 0.67 | 1.49 | |
| 4-acetamidophenol | 0.03 | 0.03 | 0.03 | 0.03 | 0.07 | 0.17 | 0.03 | 0.42 | |
| 4-acetaminophen sulfate | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.18 | 0.00 | 0.10 | |
| 4-acetylphenol sulfate | 0.35 | 0.35 | 0.35 | 0.35 | 0.35 | 0.48 | 6.68 | 0.70 | |
| 4-allylphenol sulfate | 4.65 | 3.85 | 0.46 | 0.32 | 1.73 | 2.37 | 1.08 | 1.68 | |
| 4-androsten-3alpha,17alpha-diol monosulfate (2) | 0.89 | 1.84 | 0.97 | 1.60 | 0.53 | 1.03 | 1.06 | 1.40 | |
| 4-androsten-3alpha,17alpha-diol monosulfate (3) | 0.85 | 1.01 | 1.23 | 2.17 | 0.98 | 1.13 | 1.18 | 1.45 | |
| 4-androsten-3beta,17beta-diol disulfate (1) | 0.46 | 5.67 | 1.12 | 10.18 | 0.66 | 1.49 | 0.99 | 1.21 | |
| 4-androsten-3beta,17beta-diol disulfate (2) | 0.73 | 1.75 | 1.37 | 2.08 | 0.64 | 0.98 | 0.98 | 0.91 | |
| 4-androsten-3beta,17beta-diol monosulfate (1) | 0.87 | 3.50 | 0.88 | 5.47 | 1.25 | 1.01 | 1.39 | 1.18 | |
| 4-androsten-3beta,17beta-diol monosulfate (2) | 0.47 | 3.45 | 1.45 | 4.40 | 0.85 | 1.48 | 0.91 | 1.43 | |
| 4-ethylphenylsulfate | 1.20 | 1.64 | 0.42 | 0.37 | 2.56 | 1.55 | 12.66 | 1.38 | |
| 4-guanidinobutanoate | 1.98 | 0.85 | 0.82 | 0.57 | 1.28 | 1.56 | 2.02 | 0.91 | |
| 4-hydroxyhippurate | 1.08 | 2.15 | 0.98 | 1.01 | 1.01 | 0.85 | 2.88 | 4.53 | |
| 4-hydroxyphenylpyruvate | 0.48 | 0.77 | 1.49 | 1.30 | 0.35 | 0.91 | 1.13 | 0.87 | |
| 4-imidazoleacetate | 1.75 | 0.94 | 0.99 | 1.63 | 0.75 | 1.02 | 1.14 | 0.95 | |
| 4-methyl-2-oxopentanoate | 1.12 | 1.11 | 1.77 | 1.33 | 0.84 | 1.06 | 0.95 | 1.38 | |
| 4-methylcatechol sulfate | 0.57 | 1.12 | 1.00 | 1.51 | 0.81 | 1.98 | 1.27 | 1.44 | |
| 4-vinylphenol sulfate | 0.48 | 1.81 | 0.23 | 0.59 | 0.91 | 1.66 | 1.75 | 2.40 | |
| 5,6-dihydrothymine | 1.05 | 1.29 | 0.90 | 1.13 | 0.94 | 1.00 | 0.79 | 1.11 | |
| 5,6-dihydrouracil | 1.14 | 1.41 | 0.93 | 1.45 | 0.94 | 0.99 | 0.72 | 1.19 | |
| 5,6-dihydrouridine | 0.82 | 1.07 | 0.87 | 0.97 | 0.88 | 0.96 | 0.95 | 1.35 | |
| 5-acetylamino-6-amino-3-methyluracil | 0.63 | 0.63 | 0.63 | 0.63 | 0.63 | 0.65 | 0.63 | 0.75 | |
| 5-acetylamino-6-formylamino-3-methyluracil | 0.69 | 0.69 | 0.69 | 0.69 | 0.69 | 0.71 | 0.69 | 0.80 | |
| 5alpha-androstan-3alpha,17alpha-diol monosulfate | 0.20 | 0.20 | 0.20 | 0.20 | 0.34 | 0.63 | 0.30 | 0.75 | |
| 5alpha-androstan-3alpha, 17beta-diol-17-glucosiduronate | 0.43 | 0.78 | 0.43 | 0.43 | 0.43 | 0.53 | 0.43 | 0.87 | |
| 5alpha-androstan-3alpha,17beta-diol disulfate | 0.25 | 6.26 | 0.25 | 2.53 | 0.25 | 1.01 | 0.25 | 1.01 | |
| 5alpha-androstan-3alpha,17beta-diol monosulfate (2) | 0.14 | 4.11 | 0.14 | 0.78 | 0.14 | 0.72 | 0.14 | 1.50 | |
| 5alpha-androstan-3beta,17alpha-diol disulfate | 0.45 | 0.97 | 0.95 | 2.17 | 0.90 | 1.15 | 0.73 | 1.01 | |
| 5alpha-androstan-3beta,17beta-diol disulfate | 0.26 | 10.91 | 0.63 | 16.18 | 0.42 | 1.45 | 0.67 | 2.40 | |
| 5alpha-pregnan-3(alpha or beta),20beta-diol disulfate | 21.97 | 0.95 | 6.46 | 0.51 | 5.52 | 1.03 | 37.41 | 1.92 | |
| 5alpha-pregnan-3beta,20alpha-diol disulfate | 11.69 | 1.79 | 9.13 | 2.20 | 4.19 | 1.02 | 26.88 | 0.93 | |
| 5alpha-pregnan-3beta,20alpha-diol monsulfate (2) | 8.67 | 1.47 | 2.05 | 0.66 | 3.49 | 0.91 | 15.29 | 1.14 | |
| 5-dodecenoate (12:1n7) | 1.35 | 2.22 | 0.74 | 5.42 | 1.39 | 1.12 | 0.64 | 1.10 | |
| 5-dodecenoylcarnitine (C12:1) | 0.76 | 1.79 | 0.26 | 2.99 | 1.28 | 1.28 | 0.28 | 1.14 | |
| 5-hydroxyhexanoate | 0.06 | 2.03 | 1.49 | 1.74 | 0.54 | 0.85 | 0.49 | 0.85 | |
| 5-hydroxyindoleacetate | 0.49 | 1.43 | 0.92 | 0.40 | 0.96 | 1.25 | 4.02 | 1.51 | |
| 5-methylthioadenosine (MTA) | 0.70 | 0.39 | 1.00 | 0.61 | 0.41 | 0.55 | 0.53 | 1.36 | |
| 5-methyluridine (ribothymidine) | 0.94 | 0.71 | 1.14 | 0.86 | 0.78 | 0.93 | 0.99 | 1.17 | |
| 5-oxoproline | 15.52 | 1.25 | 0.46 | 0.89 | 1.00 | 0.97 | 8.41 | 0.75 | |
| 6-bromotryptophan | 0.94 | 0.97 | 1.00 | 0.78 | 0.79 | 1.16 | 0.85 | 1.42 | |
| 6-oxopiperidine-2-carboxylic acid | 1.50 | 0.84 | 1.18 | 1.16 | 0.89 | 1.10 | 0.71 | 1.38 | |
| 7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca) | 0.95 | 1.07 | 0.83 | 0.93 | 1.13 | 1.06 | 0.94 | 1.31 | |
| 7-methylguanine | 0.65 | 0.91 | 1.11 | 1.25 | 0.56 | 1.04 | 0.83 | 1.19 | |
| 7-methylurate | 0.51 | 0.51 | 0.51 | 0.51 | 0.51 | 0.63 | 0.51 | 0.67 | |
| 7-methylxanthine | 0.27 | 0.27 | 0.27 | 0.61 | 0.27 | 0.46 | 0.27 | 0.67 | |
| acetoacetate | 0.84 | 0.75 | 0.93 | 4.49 | 1.89 | 0.99 | 0.84 | 1.83 | |
| acetylcarnitine | 0.73 | 1.11 | 0.99 | 1.46 | 0.90 | 1.05 | 0.87 | 1.45 | |
| acisoga | 1.27 | 0.85 | 1.01 | 0.97 | 0.99 | 1.02 | 0.99 | 1.00 | |
| adenosine | 0.24 | 0.70 | 4.70 | 0.82 | 1.43 | 1.05 | 0.35 | 11.61 | |
| adenosine 3^,5^-cyclic monophosphate (cAMP) | 0.80 | 0.80 | 0.80 | 0.80 | 0.80 | 0.83 | 0.80 | 0.80 | |
| adenosine 5^-monophosphate (AMP) | 0.04 | 0.73 | 8.24 | 0.10 | 0.63 | 0.60 | 0.04 | 0.97 | |
| adrenate (22:4n6) | 1.03 | 0.43 | 0.04 | 2.04 | 0.80 | 0.76 | 0.39 | 0.90 | |
| ADSGEGDFXAEGGGVR* | 0.26 | 0.65 | 0.26 | 0.26 | 0.26 | 0.85 | 0.26 | 0.26 | |
| alanine | 1.28 | 1.04 | 1.50 | 0.94 | 0.97 | 1.01 | 0.98 | 1.29 | |
| alanylleucine | 0.15 | 0.15 | 0.15 | 0.15 | 0.15 | 0.30 | 0.15 | 0.15 | |
| allantoin | 0.60 | 1.38 | 1.41 | 1.61 | 2.40 | 1.19 | 2.34 | 1.17 | |
| allo-isoleucine | 0.71 | 1.35 | 1.14 | 0.82 | 0.55 | 0.71 | 0.44 | 1.37 | |
| alpha-hydroxycaproate | 1.27 | 1.77 | 1.92 | 1.92 | 0.85 | 1.26 | 0.72 | 0.84 | |
| alpha-hydroxyisocaproate | 0.67 | 0.49 | 2.16 | 2.69 | 0.39 | 1.05 | 0.90 | 0.99 | |
| alpha-hydroxyisovalerate | 0.36 | 2.91 | 1.21 | 7.20 | 0.63 | 1.43 | 0.76 | 1.61 | |
| alpha-ketoglutarate | 1.13 | 1.13 | 0.62 | 2.52 | 0.91 | 0.91 | 0.86 | 1.92 | |
| alpha-tocopherol | 1.27 | 0.98 | 1.03 | 0.99 | 1.08 | 1.04 | 1.04 | 1.12 | |
| andro steroid monosulfate (1)* | 0.11 | 0.28 | 0.11 | 1.43 | 0.11 | 0.16 | 0.11 | 0.26 | |
| androsterone glucuronide | 0.71 | 1.25 | 0.60 | 0.49 | 0.79 | 1.16 | 1.16 | 2.08 | |
| androsterone sulfate | 0.84 | 0.86 | 0.63 | 0.92 | 1.00 | 1.23 | 1.16 | 1.33 | |
| arabinose | 1.38 | 0.96 | 0.58 | 1.05 | 1.40 | 1.20 | 1.76 | 1.29 | |
| arabonate | 1.22 | 1.27 | 0.88 | 0.86 | 1.74 | 1.31 | 1.45 | 1.10 | |
| arachidate (20:0) | 1.10 | 1.10 | 2.29 | 3.63 | 1.09 | 1.27 | 0.64 | 1.15 | |
| arachidonate (20:4n6) | 1.04 | 1.04 | 0.87 | 1.70 | 0.85 | 1.14 | 1.08 | 1.34 | |
| argininate | 0.42 | 0.60 | 0.88 | 0.43 | 0.87 | 1.04 | 1.75 | 1.71 | |
| arginine | 0.61 | 1.08 | 0.90 | 0.61 | 1.03 | 0.91 | 0.99 | 0.75 | |
| asparagine | 0.54 | 1.05 | 0.98 | 0.61 | 1.00 | 0.91 | 0.97 | 0.78 | |
| aspartate | 0.60 | 1.05 | 0.94 | 0.61 | 1.01 | 0.93 | 1.04 | 0.80 | |
| aspartylleucine | 0.89 | 0.65 | 1.99 | 1.11 | 0.55 | 0.83 | 0.55 | 0.90 | |
| azelate (nonanedioate) | 0.91 | 0.94 | 1.09 | 1.24 | 0.96 | 1.14 | 0.82 | 1.35 | |
| benzoate | 1.13 | 1.36 | 0.70 | 1.07 | 0.86 | 1.03 | 0.88 | 1.08 | |
| beta-alanine | 1.49 | 1.00 | 0.72 | 1.39 | 0.98 | 0.80 | 1.18 | 1.05 | |
| beta-hydroxyisovalerate | 1.02 | 1.03 | 1.47 | 1.40 | 0.86 | 0.86 | 0.99 | 1.16 | |
| beta-hydroxypyruvate | 0.83 | 0.89 | 0.76 | 0.82 | 0.82 | 0.71 | 1.06 | 0.75 | |
| betaine | 1.17 | 0.78 | 1.38 | 1.05 | 0.78 | 1.09 | 0.70 | 1.30 | |
| bilirubin (E,E)* | 1.30 | 1.12 | 1.53 | 1.27 | 0.69 | 1.22 | 0.45 | 1.79 | |
| bilirubin (Z,Z) | 2.60 | 0.86 | 3.07 | 1.18 | 0.62 | 1.37 | 0.37 | 2.68 | |
| biliverdin | 3.70 | 1.32 | 1.08 | 0.43 | 0.37 | 1.24 | 0.38 | 4.62 | |
| biotin | 0.75 | 1.06 | 0.88 | 0.82 | 0.99 | 0.92 | 1.02 | 0.84 | |
| bradykinin, des-arg(9) | 0.02 | 0.67 | 0.02 | 0.07 | 2.88 | 0.54 | 0.10 | 0.24 | |
| bradykinin, hydroxy-pro(3) | 0.89 | 0.80 | 0.53 | 4.88 | 0.58 | 0.60 | 0.53 | 0.64 | |
| butyrylcarnitine | 0.63 | 0.90 | 0.88 | 0.81 | 1.23 | 1.03 | 0.94 | 1.91 | |
| caffeine | 0.07 | 4.58 | 0.31 | 8.70 | 0.48 | 2.54 | 0.64 | 4.47 | |
| caprate (10:0) | 1.10 | 1.29 | 0.96 | 1.72 | 1.25 | 1.15 | 0.89 | 0.99 | |
| caproate (6:0) | 1.08 | 1.15 | 1.19 | 0.75 | 1.04 | 1.05 | 0.96 | 0.96 | |
| caprylate (8:0) | 1.00 | 1.37 | 1.26 | 1.34 | 1.07 | 1.04 | 1.01 | 1.03 | |
| carnitine | 0.74 | 0.90 | 0.98 | 0.85 | 0.88 | 1.01 | 0.85 | 1.47 | |
| catechol sulfate | 0.92 | 1.70 | 0.49 | 0.92 | 0.70 | 1.31 | 1.82 | 1.61 | |
| C-glycosyltryptophan* | 0.13 | 0.82 | 0.55 | 2.06 | 0.19 | 0.64 | 1.54 | 0.48 | |
| chenodeoxycholate | 0.93 | 4.76 | 1.31 | 0.89 | 0.79 | 1.09 | 1.03 | 1.45 | |
| cholate | 0.64 | 8.89 | 1.80 | 1.70 | 0.92 | 1.87 | 1.38 | 3.17 | |
| cholesterol | 0.99 | 1.02 | 1.17 | 0.99 | 1.11 | 1.01 | 1.04 | 1.11 | |
| choline | 0.59 | 1.06 | 1.01 | 0.69 | 1.00 | 0.94 | 0.92 | 0.90 | |
| cinnamoylglycine | 1.05 | 2.97 | 0.62 | 7.74 | 0.96 | 1.10 | 1.25 | 1.10 | |
| cis-4-decenoyl carnitine | 1.74 | 3.38 | 0.97 | 0.89 | 0.97 | 1.47 | 0.51 | 1.96 | |
| cis-vaccenate (18:1n7) | 1.05 | 1.29 | 0.56 | 3.97 | 1.12 | 1.14 | 0.85 | 1.26 | |
| citrate | 0.92 | 1.17 | 0.34 | 0.90 | 1.14 | 0.98 | 1.12 | 0.53 | |
| citrulline | 0.87 | 0.84 | 1.12 | 0.87 | 0.88 | 1.07 | 0.73 | 1.54 | |
| corticosterone | 0.69 | 0.81 | 0.69 | 0.72 | 0.81 | 0.70 | 1.69 | 0.75 | |
| cortisol | 0.84 | 1.04 | 1.07 | 1.01 | 0.78 | 0.78 | 1.27 | 0.99 | |
| cortisone | 1.20 | 0.93 | 1.48 | 1.15 | 0.73 | 0.87 | 1.03 | 1.19 | |
| cotinine | 0.29 | 0.55 | 0.29 | 0.29 | 0.29 | 0.42 | 0.29 | 0.29 | |
| creatine | 2.22 | 0.72 | 2.57 | 0.77 | 1.18 | 1.03 | 1.17 | 1.14 | |
| creatinine | 0.77 | 1.02 | 0.98 | 1.09 | 0.79 | 1.00 | 0.95 | 1.22 | |
| cyclo(leu-pro) | 0.10 | 1.36 | 0.91 | 0.81 | 0.93 | 1.85 | 0.84 | 2.28 | |
| cyclo(L-phe-L-pro) | 0.45 | 0.58 | 0.45 | 0.53 | 0.45 | 0.58 | 0.45 | 1.91 | |
| cys-gly, oxidized | 1.18 | 1.21 | 0.82 | 1.68 | 0.90 | 1.12 | 0.71 | 1.91 | |
| cysteine | 0.94 | 1.25 | 1.33 | 0.67 | 1.11 | 0.94 | 1.03 | 1.00 | |
| cysteine-glutathione disulfide | 1.27 | 1.19 | 2.58 | 0.64 | 1.61 | 1.05 | 1.04 | 0.98 | |
| cysteine sulfinic acid | 2.59 | 1.02 | 0.82 | 1.30 | 1.65 | 1.21 | 2.29 | 0.94 | |
| cystine | 0.46 | 1.46 | 0.95 | 1.25 | 1.63 | 1.00 | 0.89 | 0.80 | |
| cytidine | 0.38 | 0.50 | 1.09 | 0.69 | 0.65 | 0.59 | 0.38 | 1.03 | |
| decanoylcarnitine | 1.10 | 4.05 | 0.77 | 1.46 | 1.05 | 1.93 | 0.34 | 1.43 | |
| dehydroisoandrosterone sulfate (DHEA-S) | 1.11 | 1.30 | 0.88 | 1.59 | 1.37 | 0.91 | 1.82 | 0.84 | |
| deoxycarnitine | 0.68 | 0.92 | 1.02 | 1.10 | 0.82 | 1.04 | 0.95 | 1.49 | |
| deoxycholate | 0.91 | 0.95 | 0.85 | 1.20 | 0.82 | 1.19 | 0.92 | 1.36 | |
| dihomo-linoleate (20:2n6) | 1.54 | 1.21 | 0.95 | 3.80 | 1.21 | 1.08 | 1.01 | 1.61 | |
| dihomo-linolenate (20:3n3 or n6) | 1.38 | 1.10 | 0.73 | 1.82 | 0.93 | 1.11 | 0.99 | 1.12 | |
| dihydroferulic acid | 0.36 | 0.70 | 0.28 | 0.30 | 0.94 | 0.45 | 0.44 | 1.50 | |
| dimethylarginine (SDMA + ADMA) | 0.87 | 0.97 | 1.05 | 1.10 | 0.88 | 0.97 | 0.93 | 1.30 | |
| dimethyl sulfone | 0.35 | 1.20 | 0.35 | 1.42 | 1.32 | 1.18 | 1.40 | 1.27 | |
| docosadienoate (22:2n6) | 1.19 | 1.14 | 0.91 | 4.45 | 1.29 | 0.96 | 0.81 | 1.27 | |
| docosahexaenoate (DHA; 22:6n3) | 1.47 | 1.19 | 0.98 | 2.27 | 1.29 | 1.27 | 1.70 | 2.03 | |
| docosapentaenoate (n3 DPA; 22:5n3) | 1.22 | 1.17 | 0.74 | 2.90 | 1.07 | 1.28 | 1.39 | 1.66 | |
| docosapentaenoate (n6 DPA; 22:5n6) | 1.13 | 1.07 | 0.83 | 2.49 | 0.98 | 1.32 | 1.36 | 1.58 | |
| docosatrienoate (22:3n3) | 2.10 | 1.38 | 0.93 | 2.72 | 1.00 | 1.08 | 0.71 | 1.50 | |
| dodecanedioate | 0.36 | 0.79 | 1.42 | 2.99 | 2.06 | 1.49 | 1.17 | 1.44 | |
| DSGEGDFXAEGGGVR* | 0.11 | 0.75 | 0.11 | 0.11 | 0.18 | 0.43 | 0.11 | 0.11 | |
| eicosapentaenoate (EPA; 20:5n3) | 1.46 | 2.07 | 0.70 | 1.62 | 1.07 | 1.86 | 2.12 | 1.71 | |
| eicosenoate (20:1n9 or 11) | 0.97 | 1.24 | 0.66 | 7.08 | 1.26 | 1.15 | 0.94 | 1.86 | |
| epiandrosterone sulfate | 0.62 | 1.17 | 0.44 | 1.17 | 0.97 | 1.27 | 1.20 | 1.45 | |
| erythritol | 0.99 | 0.99 | 1.07 | 0.90 | 0.89 | 0.96 | 1.01 | 1.39 | |
| erythronate* | 0.77 | 1.13 | 0.83 | 0.74 | 1.48 | 1.20 | 1.22 | 1.17 | |
| estrone 3-sulfate | 0.33 | 0.31 | 0.31 | 0.71 | 0.45 | 0.38 | 1.11 | 0.31 | |
| ethanolamine | 2.70 | 1.07 | 0.89 | 0.64 | 1.96 | 0.91 | 1.23 | 1.11 | |
| ethyl glucuronide | 0.67 | 122.63 | 0.27 | 169.96 | 0.38 | 5.01 | 0.56 | 0.31 | |
| etiocholanolone glucuronide | 0.36 | 1.21 | 1.07 | 1.07 | 0.99 | 0.85 | 1.44 | 1.31 | |
| ferulic acid 4-sulfate | 0.18 | 0.39 | 0.18 | 0.18 | 0.24 | 0.43 | 0.74 | 0.61 | |
| folate | 0.73 | 1.17 | 0.87 | 0.73 | 0.87 | 0.93 | 0.95 | 0.85 | |
| fructose | 0.36 | 1.18 | 0.99 | 0.79 | 1.46 | 1.07 | 1.10 | 1.03 | |
| fumarate | 1.19 | 1.54 | 0.96 | 1.41 | 0.91 | 1.02 | 1.06 | 1.36 | |
| gamma-CEHC | 2.22 | 0.71 | 0.95 | 0.84 | 0.94 | 1.05 | 1.34 | 1.01 | |
| gamma-CEHC glucuronide* | 0.50 | 0.50 | 0.50 | 0.50 | 0.58 | 0.50 | 0.63 | 0.92 | |
| gamma-glutamylalanine | 0.83 | 0.81 | 1.28 | 1.20 | 0.92 | 1.10 | 0.86 | 1.39 | |
| gamma-glutamylglutamine | 0.78 | 1.48 | 0.41 | 1.21 | 0.88 | 1.23 | 1.11 | 0.99 | |
| gamma-glutamylisoleucine* | 0.65 | 1.29 | 0.78 | 0.96 | 0.80 | 1.06 | 1.04 | 0.95 | |
| gamma-glutamylleucine | 0.67 | 1.21 | 1.20 | 1.29 | 0.83 | 1.16 | 0.86 | 1.27 | |
| gamma-glutamyllysine | 0.47 | 1.68 | 0.70 | 1.45 | 0.64 | 1.21 | 1.02 | 1.21 | |
| gamma-glutamylmethionine | 0.46 | 1.44 | 1.02 | 1.37 | 0.72 | 1.29 | 1.09 | 1.29 | |
| gamma-glutamylphenylalanine | 0.87 | 1.07 | 1.49 | 1.71 | 0.80 | 1.16 | 0.74 | 1.74 | |
| gamma-glutamyltyrosine | 0.91 | 0.80 | 1.20 | 1.87 | 0.37 | 1.18 | 0.44 | 1.73 | |
| gamma-glutamylvaline | 0.83 | 1.13 | 0.98 | 1.07 | 0.87 | 1.14 | 0.84 | 1.25 | |
| gluconate | 0.94 | 0.98 | 1.09 | 0.66 | 1.26 | 1.10 | 1.21 | 0.88 | |
| glucose | 0.74 | 1.01 | 0.96 | 0.85 | 1.05 | 0.95 | 1.01 | 0.90 | |
| glutamate | 0.70 | 1.14 | 1.12 | 0.76 | 0.98 | 0.92 | 1.01 | 0.84 | |
| glutamine | 0.77 | 1.04 | 0.33 | 0.88 | 1.13 | 0.91 | 1.04 | 0.45 | |
| glutamine-leucine | 0.33 | 1.01 | 2.63 | 1.22 | 0.51 | 1.07 | 0.91 | 0.75 | |
| glutarylcarnitine (C5) | 0.54 | 1.29 | 0.74 | 1.19 | 0.99 | 1.34 | 0.88 | 2.17 | |
| glycerate | 1.16 | 1.00 | 0.93 | 0.58 | 1.20 | 1.15 | 1.51 | 1.08 | |
| glycerol | 1.36 | 1.19 | 0.83 | 1.70 | 1.00 | 1.00 | 0.96 | 0.97 | |
| glycerol 2-phosphate | 0.65 | 0.57 | 0.73 | 9.57 | 2.63 | 3.10 | 3.39 | 1.89 | |
| glycerol 3-phosphate (G3P) | 0.76 | 0.62 | 1.31 | 28.58 | 6.13 | 10.10 | 12.00 | 6.56 | |
| glycerophosphorylcholine (GPC) | 0.53 | 1.01 | 1.31 | 1.17 | 0.90 | 1.28 | 0.90 | 1.14 | |
| glycine | 2.01 | 1.05 | 1.20 | 0.96 | 1.31 | 0.99 | 1.14 | 1.23 | |
| glycochenodeoxycholate | 0.51 | 0.86 | 5.11 | 2.98 | 1.32 | 1.21 | 1.25 | 1.91 | |
| glycocholate | 0.63 | 0.63 | 3.80 | 2.66 | 1.86 | 1.46 | 1.81 | 1.47 | |
| glycocholenate sulfate* | 0.69 | 1.53 | 1.03 | 1.13 | 0.70 | 1.23 | 0.91 | 1.24 | |
| glycodeoxycholate | 0.46 | 0.35 | 3.07 | 2.33 | 2.41 | 1.90 | 2.37 | 2.48 | |
| glycodeoxycholate sulfate | 0.27 | 0.75 | 0.64 | 2.39 | 1.50 | 1.96 | 1.39 | 1.14 | |
| glycohyocholate | 0.48 | 0.73 | 1.63 | 0.63 | 4.73 | 0.81 | 0.75 | 0.66 | |
| glycolate (hydroxyacetate) | 1.18 | 1.04 | 1.04 | 0.92 | 1.33 | 1.14 | 1.24 | 0.94 | |
| glycolithocholate sulfate* | 0.44 | 0.87 | 0.78 | 2.58 | 1.23 | 1.72 | 1.59 | 2.07 | |
| glycoursodeoxycholate | 0.92 | 1.97 | 4.57 | 4.09 | 1.12 | 1.39 | 0.91 | 1.80 | |
| glycylleucine | 0.52 | 0.71 | 1.40 | 0.52 | 0.52 | 0.57 | 0.52 | 0.60 | |
| glycylphenylalanine | 0.16 | 1.61 | 0.16 | 0.25 | 1.21 | 3.40 | 0.60 | 0.65 | |
| guanidinoacetate | 0.79 | 0.52 | 0.73 | 1.31 | 0.74 | 0.93 | 0.65 | 1.52 | |
| guanine | 0.37 | 1.06 | 4.50 | 1.12 | 1.08 | 0.77 | 0.73 | 0.44 | |
| guanosine | 0.43 | 0.87 | 3.57 | 0.47 | 0.93 | 0.99 | 0.51 | 1.06 | |
| heme | 0.24 | 1.56 | 0.24 | 0.87 | 0.24 | 0.93 | 0.26 | 0.78 | |
| HEPES | 1.59 | 1.31 | 1.04 | 0.91 | 0.93 | 0.90 | 1.54 | 0.84 | |
| heptanoate (7:0) | 1.75 | 1.11 | 1.00 | 1.39 | 0.97 | 1.07 | 1.42 | 1.13 | |
| hexadecanedioate | 0.67 | 0.78 | 1.49 | 1.24 | 1.06 | 1.37 | 1.24 | 1.08 | |
| hexanoylcarnitine | 0.97 | 2.38 | 0.67 | 1.31 | 1.16 | 1.48 | 0.48 | 1.45 | |
| hexanoylglutamine | 0.30 | 1.47 | 0.30 | 12.33 | 1.23 | 1.03 | 0.43 | 1.58 | |
| hippurate | 1.71 | 1.48 | 0.80 | 1.76 | 1.13 | 1.26 | 1.75 | 1.10 | |
| histidine | 0.58 | 0.95 | 1.02 | 0.81 | 1.02 | 0.97 | 1.01 | 0.94 | |
| homocitrulline | 0.63 | 0.90 | 0.38 | 1.12 | 0.81 | 1.13 | 0.99 | 2.75 | |
| homocysteine | 3.53 | 1.21 | 0.95 | 0.26 | 1.34 | 0.76 | 2.24 | 0.89 | |
| homostachydrine* | 1.35 | 0.16 | 0.16 | 0.46 | 0.68 | 2.89 | 0.83 | 1.89 | |
| HWESASLLR | 1.10 | 0.51 | 0.74 | 0.61 | 0.52 | 1.57 | 0.50 | 0.52 | |
| HWESASXX* | 4.07 | 0.86 | 0.88 | 3.97 | 1.08 | 2.06 | 1.56 | 1.12 | |
| hydantoin-5-propionic acid | 0.55 | 0.55 | 0.55 | 1.55 | 0.55 | 0.57 | 0.55 | 1.31 | |
| hydroquinone sulfate | 0.52 | 2.00 | 0.94 | 1.19 | 0.59 | 0.81 | 1.52 | 1.53 | |
| hydroxybutyrylcarnitine* | 0.16 | 1.77 | 0.34 | 8.51 | 0.58 | 0.62 | 0.32 | 0.99 | |
| hydroxy-CMPF | 0.49 | 0.88 | 1.17 | 0.60 | 1.88 | 1.10 | 2.40 | 1.12 | |
| hydroxy-CMPF* | 0.48 | 0.79 | 1.23 | 0.53 | 1.83 | 1.03 | 2.35 | 1.09 | |
| hydroxycotinine | 0.30 | 0.99 | 0.30 | 0.30 | 0.30 | 0.46 | 0.30 | 0.30 | |
| hypoxanthine | 0.88 | 1.03 | 1.79 | 0.82 | 0.98 | 1.04 | 0.92 | 1.09 | |
| imidazole lactate | 0.55 | 1.09 | 0.59 | 1.37 | 0.75 | 1.15 | 1.02 | 1.30 | |
| indole-3-carboxylic acid | 0.58 | 2.42 | 0.84 | 1.67 | 1.31 | 1.73 | 1.21 | 0.64 | |
| indoleacetate | 0.93 | 1.03 | 1.69 | 2.74 | 0.75 | 1.28 | 1.01 | 2.39 | |
| indoleacetylglutamine | 0.15 | 0.55 | 0.22 | 0.97 | 0.55 | 0.79 | 0.65 | 2.62 | |
| indolelactate | 0.84 | 1.10 | 0.92 | 0.87 | 0.64 | 1.28 | 0.78 | 1.31 | |
| indolepropionate | 3.35 | 1.28 | 0.84 | 2.08 | 0.74 | 1.26 | 1.48 | 1.24 | |
| inosine | 0.51 | 1.15 | 3.66 | 0.53 | 1.63 | 1.11 | 0.60 | 1.04 | |
| inositol 1-phosphate (I1P) | 1.20 | 1.02 | 1.00 | 0.55 | 1.25 | 0.84 | 1.27 | 1.19 | |
| isobutyrylcarnitine | 0.87 | 0.89 | 0.84 | 1.12 | 0.95 | 0.99 | 1.77 | 1.39 | |
| isobutyrylglycine | 0.93 | 1.00 | 1.16 | 1.37 | 0.63 | 0.90 | 1.37 | 1.00 | |
| isoleucine | 0.37 | 0.92 | 1.02 | 0.72 | 0.70 | 0.95 | 0.91 | 0.69 | |
| isoleucylleucine | 0.89 | 1.07 | 2.79 | 0.44 | 1.35 | 1.49 | 1.21 | 0.93 | |
| isoleucylvaline | 0.33 | 2.62 | 0.16 | 0.16 | 2.66 | 16.13 | 0.96 | 0.32 | |
| isovalerate | 1.04 | 1.00 | 1.29 | 1.16 | 0.81 | 0.82 | 0.98 | 1.13 | |
| isovalerylcarnitine | 1.04 | 1.03 | 1.61 | 1.43 | 0.54 | 1.21 | 0.90 | 2.30 | |
| kynurenate | 1.14 | 0.85 | 0.79 | 0.76 | 1.10 | 1.22 | 0.91 | 1.28 | |
| kynurenine | 0.87 | 1.55 | 1.17 | 1.27 | 0.87 | 1.26 | 1.65 | 1.16 | |
| lactate | 1.21 | 1.17 | 1.25 | 1.14 | 0.89 | 1.01 | 0.91 | 1.13 | |
| laurate (12:0) | 1.19 | 1.19 | 0.81 | 1.32 | 1.44 | 1.03 | 1.03 | 0.99 | |
| laurylcarnitine* | 1.07 | 2.39 | 0.72 | 2.25 | 0.93 | 1.32 | 0.31 | 1.43 | |
| leucine | 0.58 | 0.89 | 1.16 | 0.77 | 0.80 | 0.94 | 0.98 | 0.84 | |
| leucylleucine | 1.54 | 1.31 | 0.79 | 1.70 | 0.94 | 1.71 | 1.27 | 0.68 | |
| linoleate (18:2n6) | 1.55 | 1.45 | 0.52 | 1.63 | 1.43 | 1.28 | 0.96 | 2.02 | |
| linoleate, methyl ester | 0.23 | 0.23 | 0.23 | 1.63 | 0.44 | 0.40 | 0.73 | 0.96 | |
| linolenate [alpha or gamma; (18:3n3 or 6)] | 2.06 | 1.52 | 0.45 | 1.53 | 1.33 | 1.43 | 0.97 | 1.59 | |
| linoleoylcarnitine* | 1.25 | 1.51 | 1.24 | 0.81 | 0.58 | 1.20 | 0.88 | 1.61 | |
| L-urobilin | 0.23 | 1.67 | 1.00 | 4.50 | 0.42 | 2.18 | 0.28 | 1.31 | |
| lysine | 0.75 | 0.97 | 1.07 | 0.68 | 0.98 | 0.96 | 1.01 | 0.93 | |
| malate | 0.89 | 1.55 | 1.17 | 2.26 | 0.77 | 0.88 | 0.99 | 1.26 | |
| mannitol | 1.15 | 1.20 | 0.78 | 5.57 | 0.73 | 1.56 | 0.98 | 1.05 | |
| mannose | 1.21 | 0.94 | 0.88 | 1.34 | 1.05 | 1.11 | 0.90 | 1.15 | |
| margarate (17:0) | 1.16 | 1.00 | 0.89 | 1.88 | 1.24 | 1.11 | 1.02 | 1.49 | |
| mead acid (20:3n9) | 0.97 | 1.33 | 0.85 | 8.80 | 0.76 | 1.69 | 1.09 | 1.87 | |
| methionine | 0.54 | 1.01 | 1.16 | 0.78 | 1.03 | 0.96 | 0.97 | 0.90 | |
| methyl glucopyranoside (alpha + beta) | 0.50 | 2.56 | 0.12 | 1.72 | 0.99 | 1.55 | 1.07 | 1.03 | |
| methyl indole-3-acetate | 0.14 | 0.14 | 0.14 | 0.68 | 0.33 | 0.44 | 0.14 | 1.27 | |
| methylnaphthyl sulfate (2)* | 0.42 | 1.73 | 0.13 | 0.13 | 2.12 | 1.83 | 1.86 | 0.53 | |
| myo-inositol | 0.68 | 1.12 | 0.99 | 0.59 | 1.00 | 0.92 | 0.99 | 0.79 | |
| myristate (14:0) | 1.10 | 1.29 | 0.76 | 1.89 | 1.34 | 1.16 | 1.02 | 1.39 | |
| myristoleate (14:1n5) | 1.37 | 1.87 | 0.35 | 3.52 | 1.40 | 1.26 | 0.78 | 1.22 | |
| myristoleoylcarnitine* | 0.92 | 2.28 | 0.56 | 3.16 | 0.87 | 1.26 | 0.25 | 1.30 | |
| myristoylcarnitine | 0.70 | 1.95 | 0.88 | 3.39 | 0.99 | 1.36 | 0.35 | 1.95 | |
| N1-Methyl-2-pyridone-5-carboxamide | 1.26 | 0.60 | 1.79 | 0.51 | 1.10 | 1.29 | 0.82 | 1.57 | |
| N1-methyladenosine | 0.84 | 1.00 | 0.92 | 0.94 | 0.84 | 1.00 | 0.90 | 1.53 | |
| N1-methylguanosine | 0.58 | 0.95 | 1.24 | 1.49 | 0.73 | 0.95 | 0.73 | 1.31 | |
| N-(2-furoyl)glycine | 0.33 | 0.58 | 0.49 | 0.84 | 0.93 | 1.16 | 1.55 | 1.44 | |
| N2,N2-dimethylguanosine | 1.05 | 1.19 | 0.86 | 1.12 | 0.83 | 0.97 | 0.99 | 1.40 | |
| N4-acetylcytidine | 0.79 | 1.08 | 0.81 | 0.99 | 0.94 | 0.98 | 0.87 | 2.09 | |
| N6-acetyllysine | 0.79 | 1.06 | 1.00 | 0.85 | 0.89 | 0.99 | 1.03 | 1.52 | |
| N6-carbamoylthreonyladenosine | 0.62 | 1.12 | 1.28 | 1.32 | 0.82 | 0.94 | 0.65 | 1.50 | |
| N-6-trimethyllysine | 1.18 | 1.10 | 1.17 | 1.01 | 0.76 | 1.02 | 0.78 | 1.79 | |
| N-acetyl-2-aminoctanoate | 0.83 | 1.17 | 0.38 | 0.87 | 1.00 | 1.45 | 0.99 | 1.52 | |
| N-acetylalanine | 0.93 | 1.03 | 1.12 | 1.16 | 0.88 | 0.99 | 1.08 | 1.34 | |
| N-acetylalliin | 0.33 | 0.33 | 0.33 | 0.33 | 0.44 | 0.40 | 0.33 | 0.33 | |
| N-acetylarginine | 0.65 | 0.65 | 0.65 | 0.82 | 0.65 | 0.65 | 0.65 | 1.22 | |
| N-acetylaspartate (NAA) | 1.17 | 0.96 | 1.64 | 0.77 | 0.97 | 0.92 | 1.13 | 1.15 | |
| N-acetyl-aspartyl-glutamate (NAAG) | 0.98 | 0.55 | 2.24 | 2.27 | 1.22 | 0.74 | 0.81 | 0.84 | |
| N-acetyl-beta-alanine | 1.09 | 1.23 | 1.69 | 0.94 | 0.70 | 1.10 | 0.80 | 1.27 | |
| N-acetylcarnosine | 0.62 | 0.98 | 0.99 | 1.49 | 0.77 | 1.22 | 0.94 | 1.70 | |
| N-acetylglutamate | 0.47 | 0.98 | 1.82 | 1.76 | 1.40 | 1.10 | 0.91 | 1.51 | |
| N-acetylglutamine | 0.84 | 2.13 | 0.88 | 1.81 | 0.98 | 1.04 | 1.16 | 0.70 | |
| N-acetylglycine | 0.60 | 2.70 | 0.92 | 1.86 | 0.95 | 1.01 | 0.77 | 1.34 | |
| N-acetylhistidine | 0.38 | 1.28 | 0.62 | 0.52 | 0.83 | 1.03 | 0.95 | 2.10 | |
| N-acetylisoleucine | 0.71 | 0.95 | 1.19 | 1.22 | 0.86 | 0.93 | 1.03 | 1.24 | |
| N-acetyl-isoputrenine* | 1.10 | 1.06 | 1.17 | 1.43 | 0.63 | 1.09 | 0.90 | 0.92 | |
| N-acetylleucine | 0.88 | 1.17 | 1.66 | 1.74 | 1.03 | 1.03 | 1.05 | 0.97 | |
| N-acetylmethionine | 1.05 | 0.86 | 1.36 | 1.13 | 0.71 | 0.91 | 1.01 | 1.34 | |
| N-acetylmethionine sulfoxide | 0.25 | 0.25 | 0.25 | 0.25 | 1.09 | 0.51 | 0.44 | 0.47 | |
| N-acetylphenylalanine | 0.89 | 1.49 | 2.03 | 1.66 | 0.67 | 1.14 | 0.96 | 1.32 | |
| N-acetylthreonine | 0.97 | 0.93 | 0.98 | 1.13 | 0.84 | 0.95 | 1.09 | 1.39 | |
| N-acetyltryptophan | 1.14 | 1.60 | 1.00 | 1.27 | 0.16 | 1.12 | 0.68 | 1.02 | |
| N-acetyltyrosine | 0.81 | 0.75 | 3.40 | 1.34 | 0.44 | 0.82 | 0.67 | 0.98 | |
| N-delta-acetylornithine | 0.99 | 0.96 | 0.21 | 1.20 | 1.08 | 1.62 | 0.84 | 5.10 | |
| N-formylmethionine | 0.91 | 1.07 | 1.25 | 1.37 | 0.84 | 1.01 | 1.01 | 1.38 | |
| nicotinamide | 0.60 | 1.11 | 0.87 | 0.58 | 1.08 | 0.94 | 1.06 | 0.74 | |
| N-methyl proline | 1.08 | 1.42 | 0.69 | 0.55 | 0.71 | 1.15 | 1.19 | 3.41 | |
| N-oleoyltaurine | 0.45 | 0.58 | 0.45 | 4.58 | 0.64 | 0.65 | 0.59 | 0.64 | |
| nonadecanoate (19:0) | 1.12 | 0.99 | 0.96 | 1.71 | 1.03 | 1.07 | 1.03 | 1.09 | |
| N-palmitoyl glycine | 1.00 | 1.11 | 0.51 | 2.15 | 1.23 | 0.99 | 1.09 | 1.29 | |
| N-palmitoyltaurine | 0.80 | 0.67 | 0.60 | 1.65 | 0.72 | 0.66 | 0.64 | 0.60 | |
| o-cresol sulfate | 0.63 | 2.47 | 0.14 | 0.52 | 0.90 | 1.06 | 3.45 | 1.83 | |
| octadecanedioate | 0.74 | 0.93 | 1.41 | 1.43 | 1.05 | 1.04 | 1.13 | 0.91 | |
| octanoylcarnitine | 1.18 | 4.20 | 0.74 | 1.53 | 1.04 | 1.96 | 0.41 | 1.58 | |
| oleate (18:1n9) | 0.89 | 1.22 | 0.59 | 3.06 | 1.41 | 1.25 | 0.93 | 1.67 | |
| oleic ethanolamide | 0.72 | 1.17 | 0.64 | 2.72 | 1.08 | 0.99 | 0.84 | 1.29 | |
| oleoylcarnitine | 0.83 | 1.64 | 1.13 | 1.32 | 0.67 | 1.22 | 0.80 | 1.38 | |
| O-methylcatechol sulfate | 0.84 | 1.26 | 0.43 | 0.50 | 0.64 | 1.71 | 1.56 | 2.19 | |
| ornithine | 1.42 | 1.04 | 0.99 | 0.69 | 1.34 | 1.01 | 1.11 | 1.01 | |
| O-sulfo-L-tyrosine | 0.72 | 0.90 | 1.39 | 1.56 | 0.47 | 1.10 | 0.95 | 1.43 | |
| p-acetamidophenylglucuronide | 0.02 | 0.02 | 0.02 | 0.02 | 0.19 | 1.11 | 0.02 | 1.61 | |
| palmitate (16:0) | 1.01 | 1.06 | 0.70 | 1.86 | 1.28 | 1.10 | 0.96 | 1.40 | |
| palmitate, methyl ester | 0.49 | 0.70 | 1.38 | 11.39 | 2.30 | 3.61 | 4.87 | 7.41 | |
| palmitoleate (16:1n7) | 0.93 | 1.80 | 0.50 | 6.30 | 1.56 | 1.74 | 0.86 | 1.91 | |
| palmitoylcarnitine | 0.72 | 1.35 | 1.09 | 1.03 | 0.80 | 1.23 | 0.98 | 1.46 | |
| palmitoyl ethanolamide | 1.01 | 1.05 | 0.79 | 1.21 | 1.03 | 1.00 | 0.97 | 1.26 | |
| palmitoyl sphingomyelin | 1.03 | 1.11 | 1.19 | 0.98 | 1.16 | 0.95 | 0.95 | 1.12 | |
| p-aminobenzoate (PABA) | 0.50 | 1.10 | 0.91 | 0.72 | 1.05 | 0.96 | 0.92 | 0.61 | |
| pantothenate | 0.55 | 1.01 | 0.89 | 0.61 | 0.97 | 0.92 | 1.02 | 0.83 | |
| paraxanthine | 0.24 | 2.89 | 0.79 | 4.46 | 0.40 | 2.23 | 0.40 | 5.78 | |
| p-cresol sulfate | 0.79 | 1.21 | 1.09 | 0.94 | 0.91 | 1.31 | 1.18 | 1.71 | |
| penicillin G | 0.89 | 0.97 | 0.36 | 0.74 | 1.01 | 0.89 | 1.08 | 0.41 | |
| pentadecanoate (15:0) | 1.11 | 1.08 | 0.83 | 1.28 | 1.14 | 1.10 | 0.97 | 1.33 | |
| phenol red | 0.84 | 0.97 | 0.92 | 0.77 | 0.99 | 0.93 | 1.01 | 0.78 | |
| phenol sulfate | 0.75 | 1.33 | 1.07 | 0.65 | 0.69 | 1.26 | 0.82 | 1.58 | |
| phenylacetylglutamine | 0.69 | 1.15 | 1.23 | 1.23 | 0.96 | 1.22 | 1.36 | 1.95 | |
| phenylacetylglycine | 0.58 | 1.05 | 2.02 | 0.57 | 1.00 | 0.98 | 0.90 | 1.51 | |
| phenylalanine | 0.76 | 1.04 | 1.18 | 0.88 | 0.99 | 1.00 | 0.93 | 0.98 | |
| phenylalanylarginine | 0.78 | 0.47 | 0.13 | 4.31 | 0.57 | 2.94 | 0.35 | 2.78 | |
| phenylalanylleucine | 0.64 | 0.79 | 1.58 | 0.58 | 0.60 | 1.02 | 0.76 | 0.80 | |
| phenylalanylphenylalanine | 0.56 | 2.00 | 1.03 | 0.61 | 0.98 | 2.32 | 0.72 | 0.83 | |
| phenylalanyltryptophan | 0.78 | 1.25 | 0.71 | 0.87 | 1.11 | 1.04 | 1.10 | 1.43 | |
| phenylcarnitine* | 0.44 | 0.78 | 0.22 | 0.45 | 0.22 | 0.74 | 0.89 | 1.24 | |
| phenyllactate (PLA) | 1.01 | 1.18 | 1.10 | 1.57 | 0.93 | 1.17 | 0.79 | 1.53 | |
| phenylpyruvate | 1.19 | 0.85 | 1.34 | 1.16 | 0.85 | 1.02 | 1.15 | 1.22 | |
| phosphate | 1.48 | 1.02 | 0.90 | 1.22 | 0.99 | 1.00 | 0.99 | 0.94 | |
| pipecolate | 1.96 | 2.58 | 1.37 | 5.98 | 0.54 | 1.38 | 0.54 | 2.32 | |
| piperine | 0.27 | 0.27 | 0.27 | 0.27 | 0.27 | 0.39 | 0.27 | 0.43 | |
| pregnanediol-3-glucuronide | 7.72 | 1.79 | 2.23 | 0.92 | 1.97 | 0.86 | 10.70 | 0.79 | |
| pregnen-diol disulfate* | 1.09 | 1.63 | 1.18 | 4.69 | 1.11 | 0.89 | 1.87 | 1.22 | |
| pregnenolone sulfate | 1.59 | 1.26 | 1.40 | 2.75 | 1.53 | 0.94 | 2.96 | 0.74 | |
| pregn steroid monosulfate* | 1.52 | 1.36 | 0.99 | 2.89 | 1.40 | 1.01 | 2.34 | 1.11 | |
| pro-hydroxy-pro | 2.66 | 0.77 | 2.33 | 1.67 | 1.49 | 1.60 | 0.97 | 1.28 | |
| proline | 0.73 | 1.12 | 1.22 | 0.93 | 0.99 | 0.97 | 0.95 | 0.96 | |
| propionylcarnitine | 0.91 | 0.85 | 1.23 | 0.66 | 0.81 | 1.09 | 1.07 | 1.61 | |
| pseudouridine | 0.68 | 0.94 | 0.99 | 1.18 | 0.83 | 1.10 | 0.87 | 1.69 | |
| pyridoxate | 0.82 | 0.85 | 0.66 | 0.48 | 1.22 | 1.12 | 1.95 | 31.73 | |
| pyridoxine (Vitamin B6) | 0.56 | 1.02 | 0.86 | 0.58 | 1.10 | 0.94 | 1.06 | 0.68 | |
| pyroglutamine* | 0.39 | 1.59 | 0.41 | 1.36 | 0.49 | 1.02 | 0.62 | 1.49 | |
| pyroglutamylglutamine | 1.04 | 1.45 | 1.15 | 0.91 | 0.98 | 1.04 | 1.32 | 0.98 | |
| pyroglutamylproline* | 0.50 | 0.97 | 0.64 | 0.75 | 0.50 | 0.98 | 0.64 | 1.10 | |
| pyruvate | 1.04 | 0.97 | 1.51 | 1.15 | 0.93 | 0.97 | 1.17 | 1.13 | |
| quinate | 0.54 | 0.74 | 0.37 | 0.92 | 0.37 | 0.49 | 1.22 | 1.29 | |
| quinine | 0.02 | 0.02 | 0.02 | 0.02 | 0.25 | 0.13 | 0.02 | 0.34 | |
| riboflavin (Vitamin B2) | 0.54 | 1.02 | 0.95 | 0.53 | 0.98 | 0.88 | 1.03 | 0.75 | |
| ribose | 1.05 | 1.15 | 1.27 | 0.92 | 1.41 | 1.00 | 1.23 | 0.82 | |
| ribulose | 0.86 | 0.82 | 0.73 | 0.79 | 1.08 | 1.15 | 1.24 | 1.01 | |
| saccharin | 0.57 | 0.37 | 0.04 | 0.04 | 0.12 | 1.11 | 0.60 | 0.48 | |
| S-adenosylhomocysteine (SAH) | 0.50 | 0.83 | 1.42 | 1.04 | 0.27 | 0.93 | 0.61 | 0.90 | |
| salicylate | 1.76 | 2.63 | 0.09 | 0.38 | 1.03 | 2.01 | 0.71 | 1.93 | |
| salicyluric glucuronide* | 0.70 | 0.35 | 0.19 | 0.19 | 0.19 | 0.27 | 0.40 | 0.56 | |
| serine | 0.56 | 1.05 | 1.07 | 0.68 | 1.04 | 0.94 | 1.03 | 0.80 | |
| S-methylcysteine | 1.79 | 1.25 | 1.00 | 3.07 | 0.69 | 1.15 | 0.56 | 2.14 | |
| sorbitol | 0.47 | 5.98 | 1.49 | 25.10 | 0.92 | 0.82 | 0.97 | 1.26 | |
| sphinganine | 1.47 | 0.92 | 1.97 | 0.63 | 1.03 | 1.10 | 1.03 | 0.91 | |
| sphingosine | 1.33 | 1.33 | 2.17 | 0.73 | 0.91 | 1.06 | 1.14 | 1.11 | |
| sphingosine 1-phosphate | 0.96 | 1.38 | 1.24 | 0.83 | 0.69 | 1.22 | 0.87 | 1.08 | |
| stachydrine | 0.41 | 1.00 | 0.62 | 0.89 | 0.92 | 2.10 | 2.27 | 4.56 | |
| stearate (18:0) | 1.11 | 1.06 | 0.91 | 2.53 | 1.07 | 1.02 | 0.94 | 1.23 | |
| stearidonate (18:4n3) | 1.70 | 1.69 | 0.38 | 0.99 | 1.10 | 1.40 | 1.04 | 1.01 | |
| stearoylcarnitine | 0.86 | 1.46 | 0.99 | 1.32 | 0.94 | 1.11 | 0.89 | 1.48 | |
| stearoyl sphingomyelin | 0.81 | 1.10 | 1.25 | 0.40 | 1.42 | 1.14 | 0.97 | 0.93 | |
| streptomycin | 0.83 | 1.07 | 0.55 | 0.90 | 1.29 | 0.99 | 1.04 | 0.68 | |
| succinate | 1.03 | 1.09 | 0.91 | 1.11 | 0.92 | 0.95 | 1.03 | 1.06 | |
| succinylcarnitine | 0.30 | 0.61 | 0.07 | 1.33 | 0.30 | 1.15 | 1.61 | 2.91 | |
| sucrose | 0.71 | 1.76 | 0.86 | 1.87 | 1.32 | 1.07 | 0.99 | 1.45 | |
| sulfate* | 0.61 | 1.03 | 0.95 | 0.64 | 1.01 | 0.96 | 1.07 | 0.89 | |
| tartarate | 0.44 | 0.51 | 0.20 | 0.20 | 1.04 | 1.11 | 2.18 | 0.92 | |
| tartronate (hydroxymalonate) | 0.62 | 0.88 | 0.78 | 0.47 | 0.95 | 1.04 | 1.54 | 1.11 | |
| taurine | 1.24 | 0.85 | 2.23 | 0.86 | 1.21 | 0.97 | 1.21 | 1.23 | |
| tauro-beta-muricholate | 0.46 | 0.16 | 1.00 | 0.16 | 0.30 | 0.31 | 0.81 | 0.42 | |
| taurochenodeoxycholate | 0.60 | 0.70 | 10.06 | 1.31 | 8.91 | 1.39 | 1.84 | 1.97 | |
| taurocholate | 0.47 | 0.45 | 5.61 | 0.71 | 19.78 | 1.53 | 1.51 | 1.20 | |
| taurocholenate sulfate | 0.71 | 1.38 | 1.03 | 1.04 | 1.84 | 1.12 | 1.89 | 1.38 | |
| taurodeoxycholate | 0.19 | 0.12 | 1.97 | 0.47 | 2.12 | 1.30 | 2.77 | 2.30 | |
| taurolithocholate 3-sulfate | 0.65 | 0.86 | 1.06 | 1.59 | 1.37 | 1.46 | 2.29 | 2.38 | |
| tetradecadienoate (14:2)* | 2.73 | 2.11 | 0.61 | 2.08 | 1.28 | 1.13 | 0.71 | 1.21 | |
| tetradecanedioate | 0.78 | 0.82 | 1.22 | 1.44 | 1.11 | 1.23 | 1.05 | 1.00 | |
| theanine | 0.05 | 0.46 | 0.05 | 0.09 | 0.05 | 0.40 | 0.05 | 1.18 | |
| theobromine | 0.70 | 1.29 | 0.22 | 2.29 | 0.28 | 0.98 | 0.42 | 2.77 | |
| theophylline | 0.16 | 0.79 | 0.12 | 2.02 | 0.12 | 0.84 | 0.12 | 1.65 | |
| thiamin (Vitamin B1) | 0.23 | 1.43 | 0.23 | 0.52 | 0.23 | 1.49 | 4.27 | 0.45 | |
| thioproline | 1.45 | 0.89 | 1.01 | 0.88 | 0.93 | 1.07 | 1.16 | 1.30 | |
| threitol | 1.13 | 1.25 | 0.70 | 0.71 | 1.09 | 0.87 | 1.08 | 1.31 | |
| threonate | 1.48 | 0.97 | 1.28 | 0.60 | 1.51 | 1.06 | 1.26 | 1.17 | |
| threonine | 0.86 | 1.03 | 1.16 | 0.70 | 0.98 | 0.93 | 1.04 | 0.85 | |
| thymol sulfate | 1.16 | 1.46 | 0.03 | 0.08 | 0.74 | 6.29 | 0.30 | 1.46 | |
| thyroxine | 1.16 | 0.91 | 2.34 | 1.46 | 0.65 | 1.25 | 0.85 | 1.05 | |
| tiglyl carnitine | 0.17 | 1.12 | 0.22 | 1.57 | 0.46 | 1.21 | 0.80 | 2.24 | |
| trans-4-hydroxyproline | 0.58 | 1.08 | 1.01 | 0.64 | 1.10 | 0.94 | 0.98 | 0.75 | |
| trigonelline (N^-methylnicotinate) | 2.34 | 0.79 | 0.23 | 1.36 | 1.17 | 1.17 | 0.87 | 2.44 | |
| tryptophan | 0.90 | 0.98 | 1.18 | 0.79 | 0.90 | 1.04 | 0.95 | 1.14 | |
| tryptophan betaine | 1.79 | 1.76 | 0.40 | 0.57 | 1.33 | 1.23 | 1.79 | 1.00 | |
| tyrosine | 0.81 | 1.05 | 1.12 | 0.81 | 1.02 | 0.97 | 0.91 | 0.89 | |
| undecanedioate | 1.00 | 1.02 | 1.01 | 1.23 | 0.96 | 1.02 | 1.02 | 1.34 | |
| uracil | 0.78 | 1.20 | 1.34 | 1.58 | 1.06 | 0.95 | 0.57 | 1.30 | |
| urate | 0.69 | 1.11 | 0.92 | 1.14 | 0.72 | 1.07 | 0.80 | 1.30 | |
| urea | 0.84 | 0.93 | 0.77 | 0.97 | 0.85 | 1.05 | 1.11 | 1.41 | |
| uridine | 1.05 | 1.00 | 0.89 | 0.97 | 0.94 | 0.99 | 1.12 | 1.20 | |
| ursodeoxycholate | 1.23 | 6.28 | 4.01 | 1.15 | 0.33 | 0.91 | 1.44 | 1.24 | |
| valerylcarnitine | 0.46 | 0.92 | 1.02 | 0.27 | 0.79 | 0.93 | 1.54 | 3.06 | |
| valine | 0.79 | 1.02 | 1.19 | 0.79 | 0.98 | 0.98 | 0.93 | 1.03 | |
| valine ion | 0.81 | 0.92 | 1.31 | 1.01 | 0.95 | 1.06 | 0.93 | 0.99 | |
| valylleucine | 0.80 | 0.86 | 1.20 | 0.17 | 0.86 | 1.15 | 0.66 | 0.53 | |
| vanillylmandelate (VMA) | 0.77 | 0.43 | 1.04 | 1.54 | 1.18 | 1.04 | 0.86 | 1.80 | |
| xanthine | 1.12 | 1.12 | 1.88 | 1.72 | 0.96 | 0.99 | 0.84 | 1.13 | |
| xanthosine | 1.10 | 1.82 | 1.35 | 2.19 | 0.46 | 0.80 | 0.39 | 1.22 | |
| xylitol | 0.69 | 2.24 | 0.39 | 5.28 | 0.53 | 0.66 | 0.46 | 0.99 | |
| xylonate | 0.81 | 0.77 | 0.69 | 0.78 | 1.06 | 1.07 | 1.17 | 1.12 | |
| xylose | 0.87 | 0.98 | 0.47 | 0.54 | 0.72 | 0.80 | 0.80 | 1.34 |
Factors:
| F1 | GROUP:case | TIMEPOINT:BL | REGION:MAK | GENDER:F |
| F2 | GROUP:case | TIMEPOINT:BL | REGION:MAK | GENDER:M |
| F3 | GROUP:case | TIMEPOINT:M06 | REGION:MAK | GENDER:F |
| F4 | GROUP:case | TIMEPOINT:M06 | REGION:MAK | GENDER:M |
| F5 | GROUP:control | TIMEPOINT:BL | REGION:MAK | GENDER:F |
| F6 | GROUP:control | TIMEPOINT:BL | REGION:MAK | GENDER:M |
| F7 | GROUP:control | TIMEPOINT:M06 | REGION:MAK | GENDER:F |
| F8 | GROUP:control | TIMEPOINT:M06 | REGION:MAK | GENDER:M |