Clustering data with hclust algorithm for (Study ST003521)
HILIC NEGATIVE ION MODE (Analysis AN005783)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 | F18 | F19 | F20 | F21 | F22 | F23 | F24 | F25 | F26 | F27 | F28 | F29 | F30 | F31 | F32 | F33 | F34 | F35 | F36 | F37 | F38 | F39 | F40 | F41 | F42 | F43 | F44 | F45 | F46 | F47 | F48 | F49 | F50 | F51 | F52 | F53 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| L-Glutamine | ME917976 | 0.07 | 1.57 | 0.19 | 13.75 | 0.22 | 0.11 | 0.48 | 0.13 | 0.21 | 0.24 | 0.10 | 0.85 | 3.53 | 4.13 | 2.41 | 2.18 | 0.05 | 0.23 | 1.58 | 0.36 | 0.05 | 0.40 | 0.17 | 0.20 | 0.23 | 1.50 | 1.80 | 0.71 | 0.09 | 0.31 | 0.42 | 0.69 | 0.21 | 0.28 | 0.12 | 0.14 | 0.09 | 0.04 | 0.18 | 1.27 | 1.33 | 0.32 | 0.13 | 6.76 | 3.14 | 0.19 | 0.96 | 0.14 | 1.28 | 0.57 | 0.63 | 0.61 | 0.63 |
| Glu-Glu-Ile | ME917655 | 0.02 | 1.83 | 0.09 | 9.95 | 0.19 | 0.09 | 0.79 | 0.09 | 0.28 | 0.61 | 0.07 | 0.62 | 4.13 | 3.35 | 2.20 | 2.04 | 0.04 | 0.90 | 4.02 | 0.38 | 0.19 | 2.70 | 0.52 | 0.23 | 0.30 | 1.09 | 2.48 | 0.63 | 0.05 | 0.44 | 0.62 | 1.90 | 0.09 | 0.28 | 0.16 | 0.21 | 0.13 | 0.02 | 0.31 | 1.32 | 0.35 | 0.10 | 0.12 | 0.75 | 2.38 | 0.12 | 0.76 | 0.05 | 1.36 | 0.71 | 0.68 | 0.73 | 0.51 |
| Apigeninidin | ME917648 | 0.57 | 4.23 | 2.09 | 12.52 | 0.44 | 0.41 | 0.65 | 0.34 | 0.42 | 0.52 | 0.48 | 1.06 | 1.08 | 1.15 | 1.20 | 1.00 | 0.22 | 0.41 | 0.82 | 0.37 | 0.20 | 0.52 | 0.55 | 0.44 | 0.35 | 0.80 | 0.90 | 0.56 | 0.16 | 0.42 | 0.60 | 0.53 | 0.37 | 0.49 | 0.51 | 0.44 | 0.33 | 0.26 | 0.72 | 1.26 | 1.31 | 1.09 | 0.38 | 3.22 | 1.19 | 0.51 | 1.02 | 0.67 | 1.24 | 0.72 | 0.74 | 0.74 | 0.74 |
| carbidopa | ME917677 | 0.25 | 3.22 | 0.94 | 8.96 | 0.67 | 0.47 | 0.90 | 0.36 | 0.60 | 0.58 | 0.50 | 1.85 | 1.82 | 2.22 | 1.67 | 1.50 | 0.28 | 0.56 | 1.71 | 0.58 | 0.22 | 0.96 | 0.69 | 0.64 | 0.43 | 1.16 | 1.40 | 0.73 | 0.21 | 0.54 | 0.72 | 1.08 | 0.62 | 0.89 | 0.56 | 0.55 | 0.20 | 0.14 | 0.45 | 1.36 | 0.97 | 0.51 | 0.16 | 2.25 | 3.23 | 0.62 | 1.99 | 0.68 | 1.26 | 0.73 | 0.73 | 0.75 | 0.80 |
| sn-glycero-3-Phosphoethanolamine | ME917906 | 0.14 | 2.35 | 0.76 | 10.31 | 0.46 | 0.43 | 0.71 | 0.34 | 0.48 | 0.39 | 0.46 | 1.19 | 1.75 | 2.44 | 1.68 | 2.88 | 0.16 | 0.48 | 1.88 | 0.69 | 0.20 | 0.63 | 0.61 | 0.48 | 0.26 | 1.07 | 1.43 | 0.68 | 0.15 | 0.43 | 0.96 | 0.88 | 0.41 | 0.56 | 0.41 | 0.40 | 0.17 | 0.14 | 0.47 | 1.20 | 0.91 | 0.55 | 0.19 | 2.46 | 1.80 | 0.46 | 1.49 | 0.53 | 1.21 | 0.70 | 0.65 | 0.68 | 0.79 |
| Ala-Gly-Pro-Ser | ME918002 | 0.21 | 0.56 | 0.30 | 1.10 | 0.11 | 0.13 | NA | 0.09 | 0.29 | 0.16 | 0.15 | 0.17 | 3.70 | 3.19 | 3.54 | 2.89 | 0.30 | 0.50 | 0.51 | 0.60 | 0.27 | 0.33 | 0.33 | 0.22 | 0.96 | 3.07 | 1.91 | 1.70 | 0.35 | 0.75 | 0.83 | 0.96 | 0.37 | 0.44 | 0.26 | 0.31 | NA | 0.08 | 0.13 | 0.27 | 4.22 | 2.19 | 0.69 | 5.98 | 1.26 | 0.47 | 0.53 | 0.30 | 1.83 | 0.97 | 0.89 | 0.74 | 0.82 |
| 3-Dehydro-L-threonate | ME917610 | 0.04 | 0.89 | 0.14 | 4.99 | 0.12 | 0.07 | 0.24 | 0.09 | NA | 0.12 | 0.05 | NA | 3.66 | 3.09 | 4.25 | 2.40 | 0.07 | 0.39 | 1.81 | 0.60 | 0.10 | 0.52 | 0.22 | 0.16 | 0.35 | 2.63 | 2.77 | 1.22 | 0.16 | 0.50 | 0.62 | 0.84 | 0.24 | 0.24 | 0.09 | 0.14 | 0.05 | 0.03 | 0.14 | 0.43 | NA | 0.93 | 0.26 | 11.36 | 2.12 | 0.26 | 0.88 | 0.15 | 1.62 | 0.74 | 0.74 | 0.71 | 0.79 |
| alpha-Ribazole | ME917657 | 0.04 | 0.85 | 0.12 | 4.21 | 0.11 | 0.06 | 0.27 | 0.08 | 0.13 | 0.11 | 0.06 | 0.32 | 4.44 | 4.20 | 3.90 | 3.14 | 0.07 | 0.37 | 1.63 | 0.56 | 0.09 | 0.51 | 0.20 | 0.14 | 0.37 | 2.43 | 3.12 | 1.20 | 0.16 | 0.45 | 0.57 | 0.78 | 0.24 | 0.22 | 0.09 | 0.16 | 0.06 | 0.03 | 0.14 | 0.57 | 2.32 | 0.91 | 0.25 | 11.15 | 1.75 | 0.26 | 0.80 | 0.14 | 1.51 | 0.65 | 0.68 | 0.68 | 0.69 |
| L,L-Cyclo(leucylprolyl) | ME918027 | 0.45 | 0.71 | 0.42 | 1.20 | 0.66 | 0.49 | 0.82 | 0.43 | 0.74 | 0.80 | 0.46 | 0.73 | 1.11 | 0.84 | 0.71 | 0.79 | 0.50 | 0.84 | 0.93 | 0.49 | 0.40 | 0.78 | 0.57 | 0.45 | 0.61 | 0.72 | 0.81 | 0.53 | 0.45 | 0.79 | 0.69 | 0.89 | 0.47 | 0.46 | 0.46 | 0.43 | 0.62 | 0.41 | 0.85 | 1.20 | 0.61 | 0.49 | 0.46 | 0.54 | 1.16 | 0.47 | 0.76 | 0.40 | 12.37 | 0.57 | 0.45 | 0.47 | 0.55 |
| PE(32:0) | ME918015 | 1.46 | 0.83 | 0.70 | 0.49 | 0.71 | 0.88 | 0.77 | 1.07 | 0.68 | 0.82 | 0.54 | 0.58 | 0.85 | 1.00 | 0.74 | 0.63 | 0.92 | 0.84 | 0.73 | 0.75 | 0.99 | 0.77 | 0.74 | 0.56 | 0.71 | 0.78 | 0.73 | 0.68 | 0.90 | 0.87 | 1.00 | 0.81 | 0.60 | 0.83 | 0.66 | 0.59 | 0.65 | 0.84 | 0.77 | 0.67 | 0.78 | 0.81 | 0.71 | 2.47 | 0.92 | 0.92 | 0.79 | 0.84 | 13.60 | 0.74 | 0.84 | 0.70 | 0.80 |
| (1S,4S)-4-Hydroxy-3-oxocyclohexane-1-carboxylate | ME917628 | 0.10 | 0.07 | 0.06 | 0.04 | 0.15 | 0.12 | 0.12 | 0.08 | 0.14 | 0.10 | 0.10 | 0.08 | 0.31 | 0.35 | 0.28 | 0.32 | 5.36 | 5.50 | 3.30 | 2.62 | 8.57 | 8.80 | 7.03 | 5.17 | 0.32 | 0.21 | 0.36 | 0.27 | 0.35 | 0.34 | 0.44 | 0.36 | 0.39 | 0.23 | 0.29 | 0.29 | 0.08 | 0.13 | 0.10 | 0.08 | 0.10 | 0.11 | 0.13 | 0.14 | 0.11 | 0.34 | 0.16 | 0.13 | 0.32 | 0.41 | 0.40 | 0.38 | 0.25 |
| 3-(Pyrazol-1-yl)-L-alanine | ME917606 | 0.03 | 0.02 | 0.02 | 0.01 | 0.19 | 0.31 | 0.23 | 0.18 | 0.33 | 0.26 | 0.29 | 0.18 | 0.40 | 0.29 | 0.30 | 0.28 | 0.67 | 4.59 | 2.57 | 2.13 | 7.42 | 6.98 | 5.28 | 4.09 | 0.17 | 0.14 | 0.32 | 0.13 | 0.74 | 0.71 | 1.05 | 0.59 | 1.82 | 1.00 | 1.86 | 1.82 | 0.07 | 0.09 | 0.09 | 0.07 | 0.02 | 0.02 | 0.03 | 0.03 | 0.07 | 0.27 | 0.13 | 0.10 | 1.21 | 1.42 | 1.42 | 1.40 | 1.18 |
| N-α-acetyl lysine methyl ester | ME917630 | 0.02 | 0.02 | 0.03 | 0.01 | 0.17 | 0.30 | 0.19 | 0.17 | 0.30 | 0.23 | 0.27 | 0.16 | 0.42 | 0.29 | 0.27 | 0.27 | 4.35 | 4.41 | 2.58 | 2.05 | 6.82 | 6.99 | 5.15 | 3.94 | 0.17 | 0.14 | 0.28 | 0.13 | 0.72 | 0.66 | 1.06 | 0.59 | 1.87 | 0.97 | 1.86 | 1.69 | 0.06 | 0.09 | 0.08 | 0.06 | 0.05 | 0.06 | 0.07 | 0.07 | 0.06 | 0.26 | 0.12 | 0.10 | 1.34 | 1.67 | 1.66 | 1.65 | 1.04 |
| Ala-Thr-Thr-Tyr | ME917546 | 0.20 | 0.17 | 0.22 | 0.17 | 0.29 | 0.51 | 0.39 | 0.43 | 0.45 | 0.45 | 0.42 | 0.26 | 0.65 | 0.52 | 0.67 | 0.40 | 3.63 | 3.49 | 2.16 | 1.61 | 5.54 | 5.69 | 4.23 | 3.34 | 0.43 | 0.50 | 0.52 | 0.30 | 0.85 | 0.81 | 1.17 | 0.70 | 1.76 | 1.02 | 1.86 | 1.50 | 0.17 | 0.34 | 0.20 | 0.16 | 0.16 | 0.33 | 0.29 | 0.20 | 0.20 | 0.44 | 0.29 | 0.21 | 1.27 | 1.55 | 1.63 | 1.55 | 1.03 |
| N-(6-Aminohexanoyl)-6-aminohexanoate | ME917881 | 0.02 | NA | NA | NA | 0.05 | 0.10 | 0.08 | 0.03 | 0.16 | 0.08 | 0.07 | 0.05 | 0.41 | 0.18 | 0.20 | 0.18 | 3.92 | 3.34 | 1.66 | 1.38 | 5.00 | 6.25 | 4.62 | 3.08 | 0.14 | 0.09 | 0.27 | 0.10 | 0.63 | 0.39 | 0.87 | 0.36 | 1.85 | 0.32 | 0.94 | 1.16 | NA | 0.04 | 0.03 | 0.01 | NA | NA | 0.02 | 0.04 | 0.02 | 0.07 | 0.06 | 0.03 | 2.14 | 1.89 | 2.01 | 2.00 | 0.66 |
| [FA methyl(11:0)] 10-methyl-undecanoic acid | ME917713 | 0.55 | 0.56 | 0.50 | 0.72 | 0.47 | 0.53 | 0.45 | 0.44 | 0.54 | 0.52 | 0.59 | 0.49 | 0.55 | 0.40 | 0.45 | 0.55 | 0.60 | 0.59 | 0.50 | 0.47 | 0.58 | 0.48 | 0.76 | 0.52 | 0.61 | 0.56 | 0.48 | 0.51 | 0.54 | 0.72 | 0.57 | 0.70 | 0.77 | 0.70 | 0.62 | 0.60 | 0.42 | 0.57 | 0.49 | 0.56 | 0.61 | 0.47 | 0.49 | 0.77 | 0.60 | 0.48 | 1.43 | 0.45 | 2.95 | 6.46 | 6.67 | 6.67 | 6.85 |
| Ile-Tyr | ME917745 | 0.59 | 0.58 | 0.59 | 0.63 | 0.38 | 0.54 | 0.43 | 0.54 | 0.59 | 0.44 | 0.56 | 0.45 | 0.38 | 0.46 | 0.39 | 0.49 | 0.59 | 0.57 | 0.45 | 0.44 | 0.44 | 0.55 | 0.69 | 0.47 | 0.73 | 0.43 | 0.54 | 0.58 | 0.50 | 0.69 | 0.81 | 0.70 | 0.63 | 0.76 | 0.54 | 0.51 | 0.34 | 0.40 | 0.44 | 0.36 | 0.35 | 0.39 | 0.36 | 0.74 | 0.55 | 0.54 | 1.53 | 0.56 | 6.69 | 5.68 | 5.17 | 5.16 | 5.48 |
| FA oxo(9:0) oxo-nonanoic acid | ME917746 | 0.08 | 0.07 | 0.12 | 0.05 | 0.14 | 0.21 | 0.12 | 0.12 | 0.27 | 0.21 | 0.49 | 0.11 | 0.30 | 0.14 | 0.24 | 0.20 | 1.66 | 1.03 | 1.15 | 1.22 | 1.57 | 2.17 | 2.08 | 1.75 | 0.26 | 0.14 | 0.14 | 0.13 | 0.47 | 0.31 | 0.78 | 0.51 | 1.36 | 0.36 | 0.72 | 1.12 | 0.03 | 0.08 | 0.05 | 0.03 | 0.07 | 0.13 | 0.10 | 0.06 | 0.12 | 0.36 | 0.27 | 0.13 | 4.74 | 8.57 | 8.42 | 8.29 | 0.72 |
| N6-Acetyl-N6-hydroxy-L-lysine | ME917725 | 0.09 | 0.06 | 0.14 | NA | 0.30 | 0.36 | 0.27 | 0.15 | 0.45 | 0.31 | 0.37 | 0.16 | 0.83 | 0.52 | 0.70 | 0.83 | 1.26 | 1.19 | 1.11 | 0.89 | 1.16 | 1.44 | 1.31 | 0.94 | 0.53 | 0.34 | 0.53 | 0.40 | 0.62 | 0.55 | 0.81 | 0.69 | 1.14 | 0.67 | 0.79 | 0.90 | 0.09 | 0.19 | 0.16 | 0.10 | 0.07 | 0.20 | 0.23 | 0.21 | 0.16 | 0.53 | 0.36 | 0.25 | 3.50 | 7.51 | 7.37 | 7.61 | 0.65 |
| (2R,4S)-2,4-Diaminopentanoate | ME917791 | 0.26 | 0.17 | 0.16 | 0.08 | 0.34 | 0.38 | 0.27 | 0.28 | 0.31 | 0.30 | 0.44 | 0.20 | 0.61 | 0.47 | 0.47 | 0.61 | 1.06 | 0.98 | 0.74 | 0.87 | 0.76 | 0.95 | 0.96 | 0.85 | 0.64 | 0.44 | 0.60 | 0.58 | 0.88 | 0.72 | 0.98 | 0.84 | 1.07 | 0.48 | 0.59 | 0.80 | 0.19 | 0.44 | 0.24 | 0.08 | 0.23 | 0.27 | 0.32 | 0.26 | 0.17 | 0.46 | 0.30 | 0.24 | 3.06 | 8.42 | 8.65 | 7.92 | 0.60 |
| Tetraacetylethylenediamine | ME917905 | 0.28 | 0.16 | 0.17 | 0.08 | 0.25 | 0.44 | 0.21 | 0.24 | 0.36 | 0.23 | 0.42 | 0.19 | 0.54 | 0.39 | 0.47 | 0.61 | 1.19 | 0.92 | 0.77 | 0.98 | 0.69 | 1.08 | 0.92 | 0.94 | 0.59 | 0.37 | 0.59 | 0.55 | 0.80 | 0.71 | 0.91 | 0.76 | 1.25 | 0.49 | 0.62 | 0.91 | 0.13 | 0.31 | 0.19 | 0.10 | 0.19 | 0.24 | 0.28 | 0.24 | 0.15 | 0.34 | 0.38 | 0.23 | 4.04 | 8.20 | 8.20 | 8.04 | 0.67 |
| gamma-L-Glutamyl-D-alanine | ME917932 | 1.17 | 0.66 | 0.53 | 0.17 | 0.19 | 0.46 | 0.04 | 0.25 | 0.64 | 0.43 | 1.14 | 0.41 | 0.02 | 0.05 | 0.03 | 0.07 | 0.76 | 0.31 | 0.25 | 0.39 | 0.73 | 1.25 | 1.08 | 1.64 | 0.31 | 0.17 | 0.12 | 0.24 | 0.68 | 0.36 | 0.37 | 0.25 | 3.55 | 1.19 | 1.12 | 2.02 | 0.14 | 0.65 | 0.27 | 0.07 | 0.28 | 0.58 | 0.34 | 0.28 | 0.13 | 0.46 | 0.76 | 0.31 | 4.03 | 8.05 | 7.53 | 7.27 | 0.77 |
| [PR] 2E,6E-farnesol | ME917794 | 1.21 | 0.26 | 0.41 | 0.07 | 0.14 | 0.28 | 0.08 | 0.17 | 0.37 | 0.24 | 0.63 | 0.17 | 0.30 | 0.24 | 0.20 | 0.22 | 1.02 | 0.45 | 0.47 | 0.39 | 0.84 | 0.77 | 0.87 | 1.25 | 0.24 | 0.15 | 0.23 | 0.18 | 0.68 | 0.29 | 0.41 | 0.39 | 2.84 | 0.68 | 0.84 | 1.29 | 0.10 | 0.48 | 0.11 | 0.05 | 0.18 | 0.31 | 0.23 | 0.15 | 0.12 | 0.37 | 0.37 | 0.26 | 5.35 | 9.65 | 8.58 | 8.07 | 0.39 |
| Ile-Ser-Val | ME917587 | 0.31 | 0.36 | 0.35 | 0.36 | 0.32 | 0.44 | 0.65 | 0.38 | 0.64 | 0.37 | 0.31 | 0.34 | 1.03 | 2.23 | 0.37 | 0.54 | 0.61 | 2.08 | 0.46 | 0.59 | 3.15 | 0.62 | 1.48 | 0.68 | 0.77 | 0.45 | 0.65 | 0.63 | 1.88 | 0.90 | 0.79 | 0.27 | 0.44 | 0.36 | 0.28 | 0.96 | 0.32 | 0.43 | 0.37 | 0.42 | 0.35 | 0.33 | 0.38 | 0.34 | 0.31 | 0.55 | 0.38 | 0.32 | 2.39 | 6.39 | 6.90 | 6.42 | 2.00 |
| 5-Oxo-D-proline | ME917620 | 0.72 | 0.31 | 0.54 | 0.13 | 0.25 | 0.65 | 0.29 | 0.41 | 0.58 | 0.27 | 0.43 | 0.29 | 0.61 | 1.02 | 0.47 | 0.46 | 1.11 | 1.56 | 0.88 | 0.92 | 3.54 | 0.88 | 2.31 | 1.53 | 0.57 | 0.52 | 0.54 | 0.63 | 1.29 | 0.64 | 1.07 | 0.60 | 0.91 | 0.64 | 0.73 | 1.60 | 0.23 | 0.58 | 0.29 | 0.19 | 0.21 | 0.28 | 0.29 | 0.25 | 0.18 | 0.40 | 0.52 | 0.34 | 2.07 | 5.14 | 5.44 | 5.38 | 1.33 |
| Oxalate | ME917613 | 0.69 | 0.34 | 0.51 | 0.12 | 0.27 | 0.62 | 0.28 | 0.39 | 0.56 | 0.26 | 0.41 | 0.28 | 0.66 | 1.09 | 0.46 | 0.50 | 1.17 | 1.60 | 0.84 | 1.06 | 3.39 | 0.84 | 2.21 | 1.47 | 0.63 | 0.54 | 0.52 | 0.67 | 1.43 | 0.75 | 1.20 | 0.64 | 0.87 | 0.61 | 0.70 | 1.53 | 0.21 | 0.56 | 0.28 | 0.20 | 0.23 | 0.27 | 0.28 | 0.28 | 0.17 | 0.38 | 0.50 | 0.32 | 2.08 | 4.93 | 5.22 | 5.16 | 1.78 |
| IMP | ME917903 | 0.06 | 0.04 | 0.04 | NA | 0.15 | 0.34 | 0.16 | 0.19 | 0.20 | 0.19 | 0.35 | 0.16 | 0.47 | 0.33 | 0.40 | 0.40 | 1.42 | 0.81 | 0.92 | 0.97 | 2.08 | 2.14 | 3.01 | 2.90 | 0.53 | 0.24 | 0.39 | 0.35 | 1.12 | 0.98 | 0.88 | 0.82 | 1.57 | 0.40 | 1.22 | 1.12 | 0.05 | 0.22 | 0.12 | 0.12 | 0.10 | 0.18 | 0.16 | 0.10 | 0.14 | 0.21 | 0.28 | 0.19 | 3.99 | 6.17 | 5.90 | 6.02 | 0.73 |
| 3-Phospho-D-glycerate | ME917912 | 0.22 | 0.17 | 0.14 | 0.10 | 0.33 | 0.48 | 0.35 | 0.36 | 0.43 | 0.32 | 0.45 | 0.30 | 0.80 | 0.76 | 0.75 | 0.82 | 1.12 | 1.03 | 1.24 | 1.15 | 0.84 | 1.24 | 1.15 | 1.18 | 0.67 | 0.48 | 0.73 | 0.61 | 0.89 | 0.79 | 1.07 | 0.96 | 1.25 | 0.60 | 0.83 | 0.96 | 0.16 | 0.30 | 0.26 | 0.16 | 0.16 | 0.22 | 0.26 | 0.34 | 0.24 | 0.36 | 0.41 | 0.26 | 3.82 | 6.45 | 6.58 | 6.72 | 0.71 |
| L-Alanine | ME918017 | NA | NA | NA | NA | 0.32 | 0.41 | 0.18 | 0.15 | 0.28 | 0.14 | 0.47 | 0.21 | 0.79 | 0.49 | 0.53 | 0.51 | 1.51 | 0.86 | 0.90 | 1.08 | 0.87 | 1.49 | 1.14 | 1.11 | 0.68 | 0.45 | 0.51 | 0.60 | 0.98 | 0.71 | 1.09 | 0.74 | 1.61 | 0.60 | 0.72 | 1.14 | 0.12 | 0.29 | 0.13 | NA | 0.13 | 0.29 | 0.25 | 0.14 | 0.14 | 0.39 | 0.40 | 0.19 | 3.36 | 6.20 | 5.81 | 6.21 | 0.70 |
| LL-2,6-Diaminoheptanedioate | ME917916 | 0.19 | 0.09 | 0.09 | NA | 0.18 | 0.22 | 0.11 | 0.11 | 0.23 | 0.16 | 0.27 | 0.09 | 0.69 | 0.53 | 0.86 | 0.67 | 1.78 | 1.36 | 1.39 | 1.07 | 1.67 | 1.68 | 1.98 | 1.48 | 0.81 | 0.56 | 0.88 | 0.71 | 0.81 | 0.76 | 0.99 | 0.96 | 1.05 | 0.42 | 0.67 | 0.70 | 0.08 | 0.17 | 0.10 | 0.09 | 0.24 | 0.38 | 0.41 | 0.38 | 0.19 | 0.28 | 0.39 | 0.23 | 2.88 | 7.35 | 6.54 | 6.43 | 0.62 |
| gamma-Glutamyl-gamma-aminobutyraldehyde | ME917998 | 0.15 | 0.06 | 0.13 | 0.04 | 0.11 | 0.22 | 0.10 | 0.10 | 0.12 | 0.11 | 0.29 | 0.08 | 1.38 | 0.52 | 1.20 | 1.04 | 2.08 | 1.20 | 1.59 | 1.30 | 1.49 | 2.41 | 2.39 | 1.67 | 0.74 | 0.34 | 1.01 | 0.64 | 0.58 | 0.34 | 1.15 | 0.77 | 1.04 | 0.22 | 0.61 | 0.85 | 0.05 | 0.12 | 0.10 | 0.04 | 0.04 | 0.11 | 0.14 | 0.05 | 0.03 | 0.10 | 0.14 | 0.08 | 3.98 | 6.94 | 6.51 | 6.67 | 0.83 |
| Ile-Pro-Pro | ME917999 | 0.15 | 0.06 | 0.13 | 0.04 | 0.10 | 0.21 | 0.09 | 0.10 | 0.12 | 0.11 | 0.29 | 0.08 | 1.35 | 0.52 | 1.24 | 1.08 | 2.05 | 1.18 | 1.57 | 1.28 | 1.47 | 2.38 | 2.35 | 1.58 | 0.63 | 0.31 | 1.07 | 0.60 | 0.54 | 0.32 | 1.12 | 0.76 | 1.02 | 0.22 | 0.60 | 0.83 | 0.05 | 0.07 | 0.07 | 0.04 | 0.04 | 0.11 | 0.14 | 0.05 | 0.03 | 0.09 | 0.13 | 0.08 | 3.92 | 6.93 | 7.23 | 6.67 | 0.82 |
| 1-hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-(1^-rac-glycerol) | ME917623 | 0.42 | 0.34 | 0.25 | 0.25 | 0.34 | 0.53 | 0.24 | 0.33 | 0.32 | 0.35 | 0.61 | 0.33 | 1.45 | 0.58 | 1.33 | 1.28 | 1.90 | 1.09 | 1.55 | 1.24 | 1.51 | 2.12 | 2.25 | 1.87 | 0.72 | 0.76 | 1.16 | 0.75 | 0.74 | 0.53 | 1.19 | 0.83 | 1.17 | 0.57 | 0.74 | 1.03 | 0.33 | 0.35 | 0.34 | 0.24 | 0.31 | 0.37 | 0.45 | 0.25 | 0.20 | 0.37 | 0.45 | 0.40 | 3.33 | 5.44 | 5.01 | 5.65 | 0.78 |
| UDP | ME917910 | 0.16 | 0.14 | 0.11 | 0.09 | 0.16 | 0.25 | 0.09 | 0.09 | 0.23 | 0.11 | 0.18 | 0.08 | 1.31 | 0.99 | 1.18 | 0.94 | 1.64 | 2.55 | 1.71 | 1.43 | 2.22 | 1.88 | 2.38 | 1.40 | 0.68 | 0.36 | 0.70 | 0.50 | 1.33 | 0.85 | 1.39 | 1.12 | 0.87 | 0.39 | 0.76 | 0.93 | 0.06 | 0.08 | 0.06 | NA | 0.11 | 0.16 | 0.29 | 0.18 | 0.11 | 0.40 | 0.20 | 0.11 | 1.44 | 5.47 | 5.91 | 5.63 | 0.59 |
| 5-Methyltetrahydropteroyltri-L-glutamate | ME917973 | NA | 0.02 | 0.05 | NA | 0.19 | 0.29 | 0.21 | 0.20 | 0.26 | 0.18 | 0.26 | 0.11 | 1.49 | 1.11 | 1.48 | 1.70 | 1.62 | 1.78 | 1.85 | 1.43 | 1.51 | 1.50 | 1.47 | 1.10 | 0.78 | 0.53 | 1.17 | 0.85 | 0.74 | 0.71 | 1.30 | 0.99 | 0.64 | 0.29 | 0.55 | 0.61 | 0.08 | 0.15 | 0.12 | 0.04 | 0.18 | 0.20 | 0.36 | 0.23 | 0.19 | 0.22 | 0.29 | 0.14 | 2.12 | 5.80 | 5.64 | 5.50 | 0.73 |
| D-4-Hydroxyphenylglycine | ME918026 | 0.04 | 0.02 | 0.04 | NA | 0.17 | 0.27 | 0.20 | 0.18 | 0.22 | 0.17 | 0.25 | 0.09 | 1.44 | 1.04 | 1.38 | 1.58 | 1.55 | 1.66 | 1.86 | 1.33 | 1.40 | 1.49 | 1.44 | 1.02 | 0.73 | 0.50 | 1.09 | 0.79 | 0.61 | 0.66 | 1.21 | 0.92 | 0.63 | 0.29 | 0.59 | 0.57 | 0.07 | 0.14 | 0.11 | 0.08 | 0.16 | 0.20 | 0.33 | 0.23 | 0.22 | 0.20 | 0.27 | 0.13 | 2.24 | 6.56 | 6.36 | 6.56 | 0.70 |
| Ala-Gly-Pro | ME917991 | NA | 0.13 | NA | 2.46 | 0.46 | 0.28 | 1.54 | 0.51 | 0.34 | 0.71 | 0.49 | 2.87 | 1.04 | 4.08 | 3.36 | 1.06 | 0.13 | 0.44 | 2.02 | 0.49 | 0.06 | 0.50 | 0.63 | 0.52 | 0.23 | 1.03 | 1.82 | 0.61 | 0.17 | 0.44 | 0.91 | 0.98 | 0.42 | 0.43 | 0.32 | 0.28 | 0.06 | NA | 0.30 | 2.66 | 0.66 | 0.21 | NA | 2.48 | 4.50 | 0.31 | 1.89 | 0.38 | 1.20 | 0.66 | 0.64 | 0.66 | 0.61 |
| homocapsaicin | ME917685 | 0.03 | 0.39 | 0.06 | 3.15 | 0.62 | 0.40 | 1.66 | 0.54 | 0.50 | 0.62 | 0.49 | 3.50 | 1.22 | 4.50 | 3.81 | 1.38 | 0.16 | 0.42 | 2.42 | 0.56 | 0.09 | 0.69 | 0.74 | 0.64 | 0.31 | 1.04 | 1.45 | 0.61 | 0.10 | 0.46 | 0.77 | 1.13 | 0.66 | 0.73 | 0.38 | 0.37 | 0.11 | 0.07 | 0.31 | 2.85 | 0.82 | 0.29 | 0.12 | 2.82 | 5.73 | 0.41 | 2.41 | 0.41 | 1.74 | 0.70 | 0.76 | 0.77 | 0.87 |
| 4-Coumarate | ME917697 | 0.26 | 1.51 | 0.33 | 2.62 | 0.81 | 0.59 | 0.95 | 0.53 | 0.60 | 0.70 | 0.43 | 1.40 | 2.27 | 1.52 | 2.40 | 1.86 | 0.28 | 0.68 | 1.25 | 0.92 | 0.44 | 1.24 | 0.71 | 0.49 | 0.53 | 2.01 | 1.74 | 1.14 | 0.46 | 1.06 | 1.43 | 1.65 | 0.70 | 0.75 | 0.55 | 0.57 | 0.28 | 0.24 | 0.63 | 1.37 | 2.07 | 0.83 | 0.29 | 4.99 | 1.29 | 0.63 | 0.97 | 0.47 | 2.10 | 0.83 | 0.98 | 1.02 | 1.12 |
| Ala-Val-Asp-Ser | ME917899 | 0.13 | 1.67 | 0.37 | 4.24 | 0.26 | 0.18 | 0.53 | 0.21 | 0.31 | NA | 0.17 | 0.49 | 2.88 | 2.58 | 3.00 | 2.26 | 0.15 | 0.33 | 0.85 | 0.41 | 0.17 | 0.47 | 0.32 | 0.27 | 0.38 | 2.07 | 1.18 | 1.05 | 0.19 | 0.59 | 0.54 | 0.63 | 0.31 | 0.37 | 0.26 | 0.34 | NA | NA | 0.31 | 0.74 | 3.34 | 1.21 | 0.34 | 5.70 | 2.21 | 0.43 | 0.94 | 0.33 | 1.49 | 0.75 | 0.65 | 0.54 | 0.86 |
| Trifluoroacetic acid | ME917668 | 0.05 | 1.03 | 0.14 | 5.30 | 0.32 | 0.24 | 0.67 | 0.24 | 0.31 | 0.28 | 0.13 | 0.85 | 3.83 | 3.22 | 3.50 | 2.82 | 0.09 | 0.47 | 2.19 | 0.67 | 0.18 | 0.93 | 0.28 | 0.25 | 0.31 | 2.29 | 2.76 | 1.27 | 0.24 | 0.69 | 1.09 | 1.13 | 0.45 | 0.40 | 0.17 | 0.29 | 0.10 | 0.06 | 0.27 | 1.02 | 1.71 | 0.50 | 0.17 | 6.00 | 2.81 | 0.31 | 1.05 | 0.19 | 1.61 | 0.72 | 0.75 | 0.73 | 0.79 |
| 4-hydroxy-3-indolylmethyl-glucosinolate | ME917851 | 0.03 | 0.61 | 0.11 | 4.22 | 0.65 | 0.47 | 2.31 | 0.46 | 0.68 | 1.55 | 0.29 | 1.77 | 1.84 | 2.31 | 1.14 | 1.39 | 0.11 | 0.80 | 2.56 | 0.34 | 0.23 | 1.23 | 0.36 | 0.48 | 0.30 | 0.52 | 1.15 | 0.35 | 0.12 | 0.41 | 0.46 | 0.80 | 0.19 | 0.33 | 0.15 | 0.15 | 0.47 | 0.20 | 1.11 | 2.88 | 0.91 | 0.31 | 0.66 | 3.24 | 5.15 | 0.42 | 0.80 | 0.13 | 1.66 | 1.31 | 1.32 | 1.36 | 1.21 |
| FA trihydroxy(18:1) | ME917810 | NA | 0.61 | NA | 4.12 | 0.46 | 0.31 | 2.27 | 0.33 | 0.46 | 0.98 | 0.21 | 0.96 | 2.59 | 3.62 | 1.11 | 1.18 | NA | 0.64 | 3.21 | 0.30 | NA | 0.47 | 0.12 | NA | 0.27 | 0.74 | 1.10 | 0.20 | NA | 0.21 | 0.23 | 0.88 | NA | 0.13 | NA | NA | 0.13 | NA | 0.39 | 1.80 | 0.53 | 0.11 | 0.10 | 3.18 | 5.17 | 0.14 | 0.76 | 0.09 | 0.93 | 0.58 | 0.41 | 0.49 | 0.51 |
| Homogentisate | ME917768 | 0.20 | 1.50 | 0.32 | 4.24 | 0.84 | 0.79 | 2.01 | 0.50 | 0.57 | 0.93 | 0.26 | 1.31 | 1.47 | 1.26 | 1.45 | 1.21 | 0.17 | 1.18 | 3.13 | 0.60 | 0.33 | 1.16 | 0.48 | 0.24 | 0.52 | 1.13 | 1.27 | 0.72 | 0.29 | 0.58 | 1.27 | 1.03 | 0.48 | 0.61 | 0.26 | 0.35 | 0.45 | 0.23 | 0.92 | 2.99 | 0.84 | 0.40 | 0.33 | 5.26 | 3.42 | 0.38 | 0.76 | 0.35 | 3.31 | 0.75 | 0.87 | 0.80 | 0.92 |
| D-Alanyl-D-alanine | ME917780 | 0.09 | 0.84 | 0.20 | 4.63 | 0.42 | 0.16 | 0.37 | 0.13 | 0.37 | 0.24 | 0.16 | 0.89 | 2.93 | 3.61 | 2.01 | 1.90 | 0.06 | 0.40 | 2.03 | 0.54 | 0.10 | 0.91 | 0.32 | 0.29 | 0.30 | 1.60 | 1.56 | 0.94 | 0.19 | 0.59 | 0.78 | 1.18 | 0.37 | 0.51 | 0.23 | 0.33 | 0.11 | 0.05 | 0.19 | 1.05 | 1.33 | 0.35 | 0.11 | 5.28 | 5.99 | 0.64 | 2.13 | 0.35 | 1.32 | 0.63 | 0.73 | 0.78 | 0.76 |
| Ile-Met-Ser | ME917726 | 0.06 | 0.81 | 0.15 | 4.86 | 0.33 | 0.30 | 0.88 | 0.37 | 0.43 | 0.40 | 0.16 | 0.91 | 2.98 | 2.45 | 2.09 | 2.31 | 0.10 | 0.49 | 2.64 | 0.63 | 0.20 | 1.12 | 0.23 | 0.37 | 0.23 | 1.66 | 2.03 | 1.07 | 0.23 | 0.61 | 0.87 | 1.29 | 0.44 | 0.41 | 0.25 | 0.31 | 0.09 | 0.10 | 0.25 | 1.06 | 1.41 | 0.44 | 0.14 | 5.22 | 6.10 | 0.70 | 1.91 | 0.31 | 1.67 | 0.76 | 0.85 | 0.85 | 0.92 |
| 15S-hydroxy,14R-(S-cysteinyl)-5Z,8Z,10E,12E-eicosatetraenoic acid | ME917554 | 0.15 | 0.89 | 0.23 | 4.16 | 0.51 | 0.49 | 1.54 | 0.44 | 0.42 | 0.51 | 0.25 | NA | 3.22 | 1.92 | 2.88 | 3.00 | 0.18 | 0.52 | 2.97 | 0.63 | 0.33 | 1.16 | 0.34 | 0.43 | 0.27 | 1.40 | 2.23 | 0.90 | 0.28 | 0.59 | 1.17 | 1.03 | 0.35 | 0.45 | 0.25 | 0.33 | 0.24 | 0.15 | 0.45 | 1.60 | 1.06 | 0.33 | 0.18 | 3.78 | 3.28 | 0.28 | 0.77 | 0.21 | 2.04 | 1.11 | 1.13 | 1.10 | 1.29 |
| PG(36:2) | ME917562 | 0.10 | 0.93 | 0.18 | 5.75 | 0.44 | 0.42 | 1.32 | 0.38 | 0.40 | 0.43 | 0.21 | 1.31 | 3.22 | 2.51 | 2.90 | 3.09 | 0.12 | 0.41 | 3.27 | 0.53 | 0.26 | 1.03 | 0.26 | 0.40 | 0.18 | 1.24 | 2.00 | 0.84 | 0.22 | 0.53 | 1.05 | 0.98 | 0.27 | 0.36 | 0.20 | 0.26 | 0.18 | 0.09 | 0.35 | 1.62 | 1.00 | 0.25 | 0.14 | 3.97 | 4.36 | 0.21 | 0.67 | 0.17 | 2.19 | 0.99 | 1.08 | 1.03 | 1.11 |
| FA (12:1) dodecenoic acid | ME917926 | 0.11 | 1.38 | 0.27 | 5.27 | 0.80 | 0.74 | 1.73 | 0.48 | 0.66 | 1.20 | 0.25 | 1.40 | 2.80 | 2.41 | 1.40 | 1.16 | 0.13 | 1.17 | 2.63 | 0.56 | 0.32 | 1.54 | 0.45 | 0.21 | 0.55 | 1.20 | 1.58 | 0.77 | 0.25 | 0.66 | 1.28 | 1.10 | 0.41 | 0.55 | 0.25 | 0.34 | 0.50 | 0.18 | 0.91 | 2.21 | 0.82 | 0.34 | 0.27 | 3.81 | 4.73 | 0.35 | 0.72 | 0.28 | 1.92 | 0.80 | 0.75 | 0.75 | 0.56 |
| Lys-Val | ME917724 | NA | 0.93 | 0.20 | 6.54 | 0.28 | 0.39 | 1.32 | 0.61 | 0.28 | 0.74 | 0.16 | 1.40 | 2.61 | 3.25 | 1.76 | 1.17 | NA | 0.41 | 2.07 | 0.45 | 0.22 | 1.12 | 0.24 | 0.18 | 0.25 | 1.45 | 1.37 | 0.39 | 0.19 | 0.71 | 0.39 | 1.19 | 0.19 | 0.21 | 0.18 | 0.15 | 0.25 | 0.15 | 0.92 | 1.93 | 0.83 | 0.45 | 0.36 | 4.14 | 3.48 | 0.16 | 0.70 | 0.13 | 1.54 | 0.79 | 0.63 | 0.76 | 0.76 |
| Carnosifloside III | ME917778 | 0.48 | 2.32 | 1.14 | 6.32 | 0.69 | 0.56 | 0.93 | 0.44 | 0.56 | 0.51 | 0.47 | 1.06 | 2.19 | 1.80 | 1.86 | 1.88 | 0.32 | 0.73 | 1.52 | 0.71 | 0.44 | 0.94 | 0.77 | 0.64 | 0.49 | 1.78 | 1.80 | 0.83 | 0.33 | 0.67 | 0.97 | 1.04 | 0.49 | 0.66 | 0.53 | 0.49 | 0.43 | 0.32 | 0.68 | 1.07 | 1.51 | 0.80 | 0.30 | 3.20 | 2.68 | 0.62 | 1.19 | 0.81 | 1.42 | 0.70 | 0.76 | 1.07 | 0.70 |
| Ala-Val-Val-Pro | ME917681 | 0.18 | 1.27 | 0.26 | 4.44 | 0.70 | 0.60 | 1.08 | 0.42 | 0.56 | 0.55 | 0.30 | 1.22 | 2.30 | 2.06 | 2.60 | 1.75 | 0.18 | 0.67 | 1.85 | 0.77 | 0.32 | 1.02 | 0.56 | 0.44 | 0.31 | 1.77 | 2.05 | 1.07 | 0.39 | 0.79 | 1.42 | 1.52 | 0.64 | 0.69 | 0.46 | 0.53 | 0.21 | 0.18 | 0.49 | 1.48 | 1.80 | 0.85 | 0.21 | 4.32 | 2.73 | 0.58 | 1.17 | 0.37 | 1.97 | 0.83 | 0.87 | 0.85 | 1.03 |
| FA (13:2) tridecadienoic acid | ME917789 | 0.22 | 1.13 | 0.31 | 4.76 | 0.67 | 0.51 | 1.09 | 0.44 | 0.63 | 0.54 | 0.36 | 1.19 | 1.62 | 1.69 | 1.92 | 1.69 | 0.23 | 0.53 | 2.29 | 0.64 | 0.45 | 0.94 | 0.46 | 0.39 | 0.36 | 1.62 | 1.56 | 1.17 | 0.36 | 0.82 | 1.33 | 1.37 | 0.50 | 0.71 | 0.47 | 0.47 | 0.13 | 0.20 | 0.47 | 1.43 | 1.32 | 0.49 | 0.18 | 3.79 | 4.09 | 0.78 | 1.79 | 0.52 | 1.81 | 0.89 | 1.11 | 1.21 | 1.14 |
| Ala-Leu-Trp-Val | ME917594 | NA | 0.21 | NA | 1.29 | 0.52 | 0.27 | 2.00 | 0.30 | 0.88 | 1.42 | 0.27 | 1.87 | 1.44 | 1.54 | 0.78 | 0.80 | 0.08 | 0.88 | 3.93 | 0.47 | 0.27 | 2.05 | 0.67 | 0.36 | 0.33 | 0.72 | 1.41 | 0.54 | 0.16 | 0.89 | 1.13 | 2.41 | 0.34 | 0.65 | 0.34 | 0.43 | 0.22 | 0.07 | 0.50 | 1.66 | 0.23 | 0.10 | 0.10 | 0.48 | 8.04 | 0.78 | 2.72 | 0.35 | 1.17 | 0.69 | 0.81 | 0.80 | 0.66 |
| PA(34:1) | ME917639 | NA | 0.44 | NA | 1.85 | 0.15 | 0.08 | 0.77 | 0.09 | 0.20 | 0.52 | NA | 0.44 | 4.70 | 4.03 | 3.12 | 2.95 | NA | 0.90 | 4.01 | 0.62 | 0.20 | 1.81 | 0.41 | 0.18 | 0.49 | 1.10 | 2.63 | 0.70 | NA | 0.50 | 0.71 | 1.44 | 0.08 | 0.18 | 0.07 | 0.14 | 0.11 | NA | 0.34 | 0.94 | 0.42 | 0.20 | 0.20 | 1.74 | 1.52 | 0.08 | 0.59 | NA | 1.23 | 0.79 | 0.84 | 0.64 | 0.83 |
| FA oxo(18:0) | ME917659 | NA | 1.04 | 0.05 | 4.06 | 0.18 | 0.11 | 0.70 | 0.10 | 0.29 | 0.56 | 0.12 | 0.64 | 4.45 | 3.74 | 3.03 | 2.53 | 0.04 | 0.99 | 4.85 | 0.58 | 0.15 | 2.18 | 0.51 | 0.21 | 0.51 | 1.29 | 3.24 | 0.96 | 0.08 | 0.51 | 0.77 | 2.09 | 0.10 | 0.24 | 0.14 | 0.18 | 0.15 | NA | 0.34 | 0.86 | 0.45 | 0.23 | 0.19 | 1.01 | 1.47 | 0.17 | 0.64 | 0.03 | 1.24 | 0.79 | 0.85 | 0.74 | 0.62 |
| Glu-Glu | ME917542 | NA | 0.92 | 0.05 | 3.82 | 0.24 | 0.10 | 1.07 | 0.12 | 0.28 | 0.60 | 0.07 | 0.62 | 5.09 | 3.81 | 2.64 | 2.39 | 0.04 | 0.95 | 4.39 | 0.45 | 0.18 | 2.41 | 0.61 | 0.22 | 0.44 | 1.10 | 2.45 | 0.64 | 0.05 | 0.50 | 0.69 | 1.66 | 0.13 | 0.26 | 0.17 | 0.15 | 0.14 | NA | 0.35 | 1.35 | 0.40 | 0.15 | 0.16 | 1.31 | 2.62 | 0.14 | 0.87 | 0.05 | 1.26 | 0.72 | 0.75 | 0.77 | 0.62 |
| 5-Methoxytryptophan | ME917565 | 0.00 | 0.39 | 0.04 | 2.71 | 0.25 | 0.13 | 1.33 | 0.14 | 0.32 | 0.54 | 0.08 | 0.72 | 4.19 | 3.98 | 2.04 | 2.16 | 0.06 | 1.00 | 6.07 | 0.36 | 0.16 | 1.91 | 0.40 | 0.22 | 0.51 | 1.03 | 2.68 | 0.62 | 0.09 | 0.63 | 0.73 | 1.95 | 0.17 | 0.28 | 0.12 | 0.21 | 0.22 | 0.06 | 0.53 | 2.44 | 0.31 | 0.11 | 0.15 | 1.17 | 4.23 | 0.19 | 0.84 | 0.07 | 1.21 | 0.87 | 0.80 | 0.83 | 0.74 |
| CTP | ME917890 | 0.00 | 0.32 | 0.04 | 1.21 | 0.52 | 0.30 | 1.65 | 0.29 | 0.41 | 0.59 | 0.05 | 0.34 | 3.12 | 2.19 | 1.73 | 1.54 | 0.11 | 1.46 | 5.33 | 0.70 | 0.30 | 2.82 | 0.80 | 0.39 | 0.71 | 1.23 | 2.74 | 0.97 | 0.14 | 0.94 | 1.19 | 2.44 | 0.29 | 0.34 | 0.18 | 0.23 | 0.35 | 0.08 | 0.76 | 2.30 | 0.44 | 0.17 | 0.22 | 1.21 | 2.80 | 0.30 | 1.38 | 0.12 | 1.31 | 1.05 | 1.03 | 0.98 | 0.90 |
| Hexanoic acid | ME917870 | NA | 0.34 | NA | 1.00 | 0.69 | 0.39 | 1.80 | 0.41 | 0.63 | 1.06 | 0.22 | 1.09 | 3.45 | 2.84 | 1.73 | 1.69 | 0.10 | 1.33 | 5.39 | 0.64 | 0.36 | 2.18 | 0.58 | 0.28 | 0.59 | 1.04 | 2.15 | 0.60 | 0.10 | 0.62 | 0.93 | 1.62 | 0.21 | 0.39 | 0.18 | 0.21 | 0.49 | 0.12 | 0.83 | 2.89 | 0.37 | 0.18 | 0.24 | 0.89 | 2.89 | 0.22 | 0.88 | 0.11 | 1.33 | 0.60 | 0.72 | 0.66 | 0.73 |
| Hydroxypyruvate | ME917658 | 0.01 | 0.44 | 0.05 | 2.09 | 0.51 | 0.27 | 1.94 | 0.30 | 0.64 | 1.11 | 0.17 | 1.30 | 3.16 | 2.78 | 1.65 | 1.61 | 0.06 | 1.01 | 4.95 | 0.44 | 0.21 | 2.05 | 0.55 | 0.30 | 0.53 | 1.06 | 2.38 | 0.64 | 0.13 | 0.86 | 1.08 | 2.35 | 0.29 | 0.50 | 0.24 | 0.35 | 0.32 | 0.08 | 0.72 | 2.74 | 0.34 | 0.14 | 0.16 | 0.96 | 4.44 | 0.28 | 1.20 | 0.12 | 1.24 | 0.83 | 0.83 | 0.83 | 0.77 |
| UDP-2,3-diacetamido-2,3-dideoxy-α-D-glucuronate | ME917888 | 0.01 | 0.29 | 0.04 | 1.35 | 0.39 | 0.23 | 1.58 | 0.25 | 0.46 | 0.77 | 0.12 | 0.84 | 3.76 | 2.93 | 2.14 | 2.18 | 0.08 | 1.27 | 5.95 | 0.52 | 0.23 | 2.18 | 0.59 | 0.29 | 0.55 | 1.00 | 2.58 | 0.74 | 0.11 | 0.71 | 0.93 | 1.99 | 0.22 | 0.36 | 0.18 | 0.26 | 0.28 | 0.06 | 0.64 | 2.28 | 0.34 | 0.13 | 0.18 | 1.00 | 4.16 | 0.24 | 1.03 | 0.09 | 1.21 | 0.87 | 0.82 | 0.82 | 0.78 |
| cis-2-hydroxypenta-2,4-dienoate | ME917634 | 0.01 | 0.50 | 0.05 | 1.62 | 0.67 | 0.32 | 2.04 | 0.36 | 0.79 | 1.20 | 0.21 | 1.45 | 2.53 | 1.54 | 1.74 | 1.45 | 0.08 | 1.17 | 3.56 | 0.55 | 0.25 | 2.46 | 0.70 | 0.32 | 0.58 | 1.31 | 2.47 | 0.80 | 0.17 | 1.09 | 1.33 | 2.84 | 0.38 | 0.64 | 0.32 | 0.45 | 0.40 | 0.09 | 0.82 | 2.48 | 0.39 | 0.15 | 0.19 | 1.16 | 2.33 | 0.33 | 1.60 | 0.15 | 1.15 | 0.96 | 0.99 | 0.96 | 0.89 |
| Mesaconate | ME917583 | NA | 0.28 | 0.05 | 0.90 | 0.84 | 0.54 | 2.88 | 0.54 | 1.04 | 1.65 | 0.31 | 1.66 | 2.19 | 1.58 | 1.37 | 1.47 | 0.10 | 1.30 | 5.23 | 0.63 | 0.39 | 2.78 | 0.89 | 0.47 | 0.41 | 0.65 | 1.60 | 0.50 | 0.11 | 0.64 | 0.94 | 1.60 | 0.25 | 0.48 | 0.27 | 0.32 | 0.41 | 0.10 | 1.01 | 2.47 | 0.37 | 0.17 | 0.21 | 0.92 | 3.42 | 0.26 | 1.24 | 0.15 | 1.21 | 0.82 | 0.78 | 0.80 | 0.78 |
| NicotinamideN-oxide | ME917766 | NA | 0.27 | 0.02 | 1.02 | 1.07 | 0.64 | 2.77 | 0.67 | 1.22 | 1.83 | 0.38 | 1.60 | 1.96 | 1.26 | 1.56 | 1.27 | 0.11 | 1.43 | 4.01 | 0.89 | 0.50 | 3.49 | 1.09 | 0.47 | 0.44 | 0.80 | 1.79 | 0.59 | 0.13 | 0.68 | 0.86 | 0.86 | 0.28 | 0.47 | 0.31 | 0.39 | 0.48 | 0.11 | 0.93 | 2.35 | 0.42 | 0.19 | 0.22 | 1.04 | 2.46 | 0.29 | 1.51 | 0.16 | 1.28 | 0.85 | 0.88 | 0.90 | 0.82 |
| D-Gluconic acid | ME917764 | NA | 0.37 | 0.11 | 1.32 | 1.05 | 0.63 | 2.58 | 0.74 | 1.01 | 1.64 | 0.46 | 1.63 | 2.17 | 1.65 | 1.43 | 1.57 | 0.11 | 1.17 | 3.33 | 0.55 | 0.40 | 2.48 | 1.09 | 0.48 | 0.55 | 0.84 | 1.74 | 0.63 | 0.13 | 0.62 | 0.86 | 1.11 | 0.25 | 0.44 | 0.35 | 0.33 | 0.83 | 0.24 | 1.44 | 3.55 | 0.44 | 0.25 | 0.21 | 0.81 | 2.43 | 0.26 | 0.95 | 0.18 | 1.42 | 0.73 | 0.86 | 0.81 | 0.77 |
| Hymenoflorin | ME917699 | 0.01 | 0.48 | 0.06 | 1.91 | 1.03 | 0.55 | 3.16 | 0.61 | 1.33 | 2.16 | 0.44 | 2.52 | 1.86 | 1.50 | 1.05 | 1.00 | 0.07 | 1.00 | 3.95 | 0.46 | 0.35 | 2.58 | 0.89 | 0.45 | 0.33 | 0.63 | 1.33 | 0.41 | 0.13 | 0.74 | 0.95 | 1.70 | 0.35 | 0.64 | 0.37 | 0.44 | 0.50 | 0.12 | 1.11 | 3.25 | 0.31 | 0.15 | 0.15 | 0.70 | 3.09 | 0.28 | 1.24 | 0.18 | 1.24 | 0.83 | 0.80 | 0.83 | 0.78 |
| FAD | ME917894 | NA | NA | NA | NA | 0.49 | 0.16 | NA | 0.12 | 0.29 | 0.45 | 0.54 | 0.30 | 0.41 | NA | 0.34 | 0.56 | 4.74 | 1.72 | 2.07 | 1.52 | 0.74 | 5.48 | 1.24 | 1.67 | 0.22 | 0.16 | 0.13 | NA | 0.40 | 0.51 | 0.70 | 0.93 | 2.56 | 0.99 | 2.77 | 0.45 | NA | 0.13 | NA | NA | NA | NA | NA | NA | 0.13 | 0.27 | NA | 0.12 | 0.71 | NA | NA | NA | NA |
| Bis-D-fructose 2^,1:2,1^-dianhydride | ME917556 | 0.15 | 2.27 | 0.51 | 5.91 | 1.41 | 0.52 | 3.51 | 1.30 | 1.83 | 2.09 | 0.46 | 2.32 | 0.88 | 0.68 | 0.32 | 0.43 | NA | 0.29 | 0.72 | NA | NA | 0.42 | 0.04 | NA | NA | 0.39 | 0.77 | 0.11 | NA | 0.14 | 0.31 | 0.43 | NA | NA | NA | NA | 0.99 | 0.29 | 1.62 | 3.31 | 0.93 | 0.49 | 0.49 | 1.25 | 1.11 | 0.07 | 0.26 | 0.09 | 1.39 | 0.59 | 0.55 | 0.64 | 0.71 |
| GTP | ME917892 | 0.43 | 1.05 | 0.56 | 1.72 | 0.91 | 0.66 | 1.30 | 0.77 | 0.90 | 1.60 | 0.62 | 0.94 | 0.88 | 1.56 | 1.06 | 0.90 | 0.47 | 1.09 | 1.41 | 0.72 | 0.77 | 1.12 | 0.78 | 0.61 | 2.21 | 0.99 | 1.10 | 0.85 | 0.51 | 0.96 | 0.95 | 1.12 | 0.55 | 0.69 | 0.67 | 0.61 | 2.00 | 0.55 | 1.01 | 1.55 | 0.82 | 0.62 | 1.74 | 4.30 | 2.50 | 0.84 | 0.91 | 0.62 | 1.57 | 0.75 | 0.78 | 0.85 | 0.95 |
| Citrate | ME917591 | 0.39 | 0.50 | 0.76 | 1.55 | 0.77 | 1.14 | 1.40 | 0.81 | 0.75 | 1.20 | 0.92 | 0.86 | 0.87 | 0.72 | 1.11 | 1.56 | 0.60 | 0.70 | 0.88 | 0.79 | 0.59 | 1.41 | 0.62 | 0.69 | 1.34 | 0.94 | 1.34 | 1.28 | 0.65 | 0.88 | 0.91 | 1.21 | 0.57 | 0.27 | 0.29 | 0.48 | 1.26 | 0.89 | 1.23 | 0.97 | 1.44 | 1.12 | 1.26 | 7.06 | 0.48 | 0.66 | 0.74 | 0.54 | 1.88 | 1.49 | 1.55 | 1.69 | 1.81 |
| D-Glucarate | ME917604 | 0.95 | 1.10 | 2.55 | 3.63 | 0.68 | 0.91 | 1.34 | 0.68 | 0.73 | 0.95 | 0.90 | 0.77 | 0.72 | 0.64 | 1.15 | 1.52 | 0.48 | 0.57 | 0.68 | 0.66 | 0.49 | 1.10 | 0.58 | 0.63 | 1.02 | 0.75 | 1.29 | 1.23 | 0.47 | 0.77 | 0.80 | 0.92 | 0.42 | 0.59 | 0.68 | 0.46 | 1.05 | 0.65 | 1.57 | 0.92 | 1.06 | 0.83 | 1.34 | 7.57 | 0.58 | 0.52 | 0.88 | 1.59 | 1.46 | 0.56 | 0.93 | 1.32 | 1.26 |
| D-galactosylononitol | ME917593 | 0.84 | 1.35 | 1.60 | 5.05 | 0.61 | 0.92 | 1.28 | 0.61 | 0.67 | 1.07 | 0.69 | 0.70 | 1.05 | 0.82 | 1.05 | 1.42 | 0.46 | 0.64 | 1.06 | 0.62 | 0.45 | 1.41 | 0.47 | 0.56 | 1.12 | 0.85 | 1.33 | 1.04 | 0.51 | 0.78 | 0.85 | 1.01 | 0.41 | 0.67 | 0.64 | 0.44 | 0.96 | 0.67 | 1.01 | 1.07 | 1.18 | 0.87 | 1.08 | 5.01 | 1.05 | 0.53 | 0.76 | 1.46 | 2.14 | 1.22 | 1.30 | 1.32 | 1.29 |
| D-Phenylalanine | ME917638 | 0.74 | 1.23 | 2.01 | 5.81 | 0.61 | 0.86 | 1.57 | 0.57 | 0.66 | 0.96 | 0.76 | 0.71 | 1.00 | 0.80 | 1.11 | 1.48 | 0.36 | 0.58 | 1.05 | 0.60 | 0.40 | 1.26 | 0.47 | 0.49 | 1.07 | 0.75 | 1.20 | 1.10 | 0.41 | 0.71 | 0.72 | 1.00 | 0.36 | 0.53 | 0.56 | 0.42 | 0.92 | 0.61 | 1.45 | 1.21 | 1.06 | 0.73 | 1.23 | 5.58 | 0.88 | 0.44 | 0.86 | 1.37 | 1.99 | 1.16 | 1.20 | 1.22 | 1.14 |
| Maltose | ME917597 | 0.97 | 1.25 | 1.79 | 4.17 | 0.70 | 0.99 | 1.35 | 0.70 | 0.79 | 1.15 | 0.80 | 0.77 | 1.13 | 0.80 | 1.15 | 1.53 | 0.51 | 0.65 | 1.25 | 0.73 | 0.57 | 1.49 | 0.56 | 0.60 | 1.32 | 0.95 | 1.59 | 1.11 | 0.60 | 0.82 | 0.90 | 1.08 | 0.47 | 0.20 | 0.39 | 0.30 | 1.05 | 0.77 | 1.13 | 1.04 | 1.34 | 0.98 | 1.10 | 5.10 | 1.00 | 0.61 | 0.82 | 1.58 | 1.09 | 0.77 | 1.44 | 1.08 | 0.91 |
| Sucrose | ME917617 | 0.87 | 1.27 | 2.44 | 4.01 | 0.67 | 0.96 | 1.57 | 0.67 | 0.72 | 1.08 | 0.85 | 0.74 | 0.97 | 0.83 | 1.23 | 1.59 | 0.42 | 0.49 | 0.75 | 0.49 | 0.48 | 1.43 | 0.53 | 0.55 | 1.17 | 0.77 | 1.24 | 1.23 | 0.47 | 0.48 | 0.54 | 0.70 | 0.43 | 0.62 | 0.65 | 0.45 | 0.74 | 0.66 | 1.56 | 1.00 | 1.16 | 0.82 | 1.38 | 5.38 | 0.78 | 0.46 | 0.96 | 1.49 | 1.89 | 1.31 | 1.34 | 1.36 | 1.31 |
| PS(18:0) | ME917547 | 1.11 | 3.80 | 2.49 | 6.19 | 1.08 | 1.08 | 1.33 | 0.91 | 0.80 | 0.96 | 0.85 | 1.14 | 0.21 | 0.69 | 0.54 | 0.34 | 0.31 | 0.55 | 0.47 | 0.38 | 0.22 | 0.39 | 0.48 | 0.42 | 0.74 | 0.44 | 0.55 | 0.28 | 0.21 | 0.42 | 0.40 | 0.46 | 0.50 | 0.49 | 0.44 | 0.49 | 1.17 | 0.75 | 1.19 | 1.42 | 1.57 | 1.34 | 1.75 | 2.44 | 0.76 | 0.67 | 1.03 | 0.72 | 1.72 | 1.20 | 1.17 | 1.06 | 0.91 |
| Asn-Leu-Pro-Pro | ME917963 | 1.01 | 2.45 | 1.79 | 4.56 | 0.65 | 0.85 | 0.83 | 0.73 | 0.44 | 0.65 | 0.49 | 0.56 | 1.02 | 1.25 | 1.35 | 1.01 | 0.49 | 0.88 | 1.14 | 0.77 | 0.39 | 0.81 | 0.58 | 0.49 | 1.38 | 0.90 | 1.37 | 0.93 | 0.48 | 0.68 | 0.85 | 0.85 | 0.70 | 0.46 | 0.48 | 0.55 | 1.30 | 1.00 | 1.39 | 1.76 | 1.05 | 0.92 | 1.09 | 1.86 | 0.81 | 0.58 | 0.86 | 0.57 | 1.75 | 1.06 | 1.15 | 1.08 | 0.96 |
| UMP | ME917605 | 0.47 | 3.02 | 1.22 | 4.46 | 1.03 | 0.80 | 1.47 | 0.85 | 1.22 | 1.86 | 0.96 | 1.56 | 0.88 | 1.20 | 1.14 | 1.19 | 0.25 | 1.04 | 1.19 | 0.68 | 0.46 | 1.05 | 0.75 | 0.42 | 0.52 | 0.65 | 1.03 | 0.56 | 0.28 | 0.62 | 0.77 | 0.84 | 0.45 | 0.72 | 0.66 | 0.38 | 0.64 | 0.37 | 0.74 | 1.02 | 1.04 | 0.87 | 1.02 | 1.93 | 0.92 | 0.53 | 1.26 | 0.51 | 1.64 | 1.15 | 1.16 | 0.53 | 1.04 |
| ATP | ME917898 | 0.17 | 1.14 | 0.42 | 2.30 | 1.32 | 0.97 | 1.57 | 0.97 | 1.07 | 1.35 | 0.72 | 2.33 | 2.19 | 2.46 | 1.55 | 1.61 | 0.29 | 1.14 | NA | 0.66 | 0.30 | 1.04 | 0.78 | 0.45 | 0.52 | 1.23 | 1.49 | 0.81 | 0.17 | 0.77 | 0.81 | 1.56 | 0.56 | 0.68 | 0.43 | 0.50 | 0.59 | 0.52 | 1.67 | 2.38 | 0.96 | 0.60 | 0.22 | 1.64 | NA | 0.49 | 1.36 | 0.54 | 1.23 | 0.56 | 0.53 | 0.63 | 0.74 |
| D-Glutamine | ME917748 | 1.32 | 1.36 | 1.03 | 1.31 | 1.51 | 1.24 | 1.28 | 1.06 | 1.12 | 1.12 | 0.85 | 0.62 | 1.46 | 1.41 | 0.97 | 1.25 | NA | NA | 0.51 | NA | NA | 0.20 | NA | NA | 1.25 | 1.43 | 1.07 | 1.28 | 1.09 | 0.64 | NA | 0.94 | 0.37 | 0.45 | 0.40 | 0.24 | 2.17 | 2.04 | 1.96 | 1.48 | 0.67 | 0.78 | 0.81 | 1.32 | NA | NA | 0.63 | 0.46 | 0.78 | 0.45 | 0.54 | 0.48 | 0.62 |
| Gln-Pro-His-His | ME917966 | 1.26 | 1.80 | 1.36 | 2.76 | 1.36 | 1.19 | 0.99 | 1.21 | 1.07 | 1.06 | 0.80 | 0.98 | 1.19 | 1.50 | 0.84 | 0.89 | 0.49 | 0.57 | 0.71 | 0.74 | 0.54 | 0.44 | 0.42 | 0.39 | 1.26 | 1.01 | 0.79 | 0.79 | 0.62 | 0.78 | 0.71 | 0.70 | 0.65 | 0.63 | 0.63 | 0.65 | 1.52 | 1.25 | 1.52 | 2.20 | 1.16 | 1.22 | 0.89 | 2.32 | 0.75 | 0.63 | 0.96 | 0.86 | 0.66 | 0.77 | 0.77 | 0.84 | 0.90 |
| FA dimethyl(16:0) | ME917552 | 0.87 | 0.60 | 0.35 | 3.94 | 0.72 | 1.62 | 5.68 | 0.36 | 0.59 | 1.27 | 0.32 | 1.36 | 0.91 | 1.47 | 1.27 | 0.62 | 0.75 | 1.85 | 1.63 | 0.39 | 0.47 | 1.03 | 0.76 | 0.42 | 0.98 | 0.44 | 0.60 | 0.70 | 0.57 | 0.66 | 0.85 | 1.98 | 0.34 | 0.61 | 0.63 | 0.88 | 0.33 | 0.49 | 0.50 | 0.82 | 0.44 | 0.63 | 0.83 | 0.73 | 1.89 | 0.63 | 0.53 | 0.35 | 2.82 | 1.65 | 1.65 | 1.72 | 2.17 |
| N-hydroxy DAP | ME917819 | 1.02 | 0.67 | 0.48 | 3.08 | 0.87 | 1.59 | 3.92 | 0.47 | 0.68 | 1.28 | 0.46 | 1.19 | 1.14 | 1.59 | 1.31 | 0.76 | 0.68 | 1.66 | 2.00 | 0.48 | 0.56 | 1.07 | 0.93 | 0.49 | 1.05 | 0.58 | 0.56 | 0.76 | 0.67 | 0.61 | 0.97 | 1.86 | 0.45 | 0.73 | 0.77 | 0.90 | 0.41 | 0.53 | 0.62 | 1.08 | 0.54 | 0.64 | 0.72 | 0.73 | 2.96 | 0.85 | 0.67 | 0.51 | 2.55 | 0.36 | 1.57 | 1.68 | 1.76 |
| FA hydroxy(9:0) hydroxy-nonanoic acid | ME917800 | 0.30 | 1.51 | 0.25 | 1.34 | 0.33 | 0.69 | 2.87 | 0.20 | 1.18 | 3.16 | 0.41 | 1.27 | 2.20 | 1.96 | 2.11 | 0.78 | 0.49 | 2.10 | 2.86 | 0.32 | 0.25 | 0.80 | 0.63 | 0.52 | 0.81 | 0.40 | 0.50 | 0.62 | 1.09 | 0.34 | 0.76 | 1.94 | 0.26 | 0.50 | 0.27 | 0.99 | 0.98 | 0.66 | 0.56 | 2.22 | 0.62 | 0.65 | 0.46 | 1.50 | 1.63 | 0.40 | 0.91 | 0.69 | 2.35 | 1.14 | 1.24 | 0.95 | 0.77 |
| Phenylalanyl-Threonine | ME917788 | 0.40 | 1.69 | 0.40 | 0.61 | 0.43 | 0.66 | 3.81 | 0.29 | 1.26 | 4.85 | 0.30 | 1.35 | 2.15 | 0.96 | 3.06 | 1.12 | 0.51 | 2.09 | 2.24 | 0.14 | 0.21 | 0.88 | 0.43 | 0.40 | 0.91 | 0.37 | 0.47 | 0.65 | 1.14 | 0.45 | 0.76 | 2.79 | 0.38 | 0.55 | 0.30 | 0.90 | 1.31 | 0.60 | 0.47 | 1.57 | 0.73 | 0.70 | 0.32 | 1.62 | 1.11 | 0.51 | 0.62 | 0.71 | 1.86 | 1.39 | 1.11 | 1.03 | 0.88 |
| Carbetamide | ME917820 | 0.58 | 1.27 | 0.49 | 0.81 | 0.44 | 1.06 | 1.46 | 0.31 | 1.22 | 2.87 | 0.32 | 1.18 | 1.14 | 0.48 | 1.45 | 0.46 | 0.49 | 1.57 | 1.32 | 0.36 | NA | 0.35 | 0.42 | 0.77 | 1.16 | 0.36 | 0.36 | 0.35 | 2.47 | 0.51 | 1.17 | 1.53 | 0.26 | 0.87 | 0.38 | 1.66 | 1.75 | 1.29 | 0.67 | 0.84 | 0.48 | 1.19 | 0.30 | 3.02 | 0.52 | 0.42 | 0.27 | 1.08 | 1.99 | 1.85 | 2.08 | 2.43 | 1.67 |
| Ala-Ala-Ser | ME917839 | 0.77 | 1.69 | 0.55 | 0.64 | 0.41 | 0.92 | 1.49 | NA | 1.48 | 3.30 | 0.50 | 0.95 | 1.00 | 0.61 | 1.91 | 0.40 | 1.21 | 2.02 | 1.01 | 0.37 | NA | 1.15 | 0.91 | 0.93 | 0.95 | 0.48 | 0.48 | 1.14 | 1.19 | 0.47 | 0.52 | 1.62 | 0.65 | 0.68 | 0.40 | 1.58 | 1.56 | 0.84 | 0.49 | 1.27 | 0.88 | 1.06 | 0.38 | 1.68 | 1.13 | 0.40 | 0.48 | 0.97 | 1.27 | 1.25 | 1.38 | 1.33 | 1.08 |
| L-Erythrulose | ME917786 | 0.71 | 1.73 | 0.66 | 0.58 | 0.25 | 1.15 | 1.82 | 0.25 | 1.75 | 3.96 | 0.48 | 1.16 | 1.12 | 0.65 | 2.02 | 0.79 | 0.62 | 2.35 | 0.92 | 0.23 | 0.33 | 1.07 | 0.59 | 0.86 | 0.97 | 0.63 | 0.60 | 0.77 | 1.21 | 0.58 | 0.63 | 1.79 | 0.40 | 0.75 | 0.50 | 1.43 | 1.79 | 0.83 | 0.54 | 1.29 | 0.82 | 1.16 | 0.48 | 1.96 | 1.09 | 0.90 | 0.39 | 1.06 | 1.66 | 1.74 | 1.64 | 1.72 | 1.09 |
| Thr-Ala-Ala | ME917835 | 3.64 | 1.13 | 1.99 | NA | 0.38 | 1.07 | 0.30 | 1.16 | 1.03 | NA | 1.01 | 0.46 | 0.32 | NA | 0.33 | 0.81 | 1.18 | 0.52 | 0.52 | 0.71 | 1.21 | 0.25 | 0.74 | 1.00 | 1.82 | 1.35 | 0.80 | 1.61 | 1.61 | 0.67 | 0.74 | 0.66 | 1.10 | 0.92 | 0.95 | 0.69 | 0.89 | 2.26 | 0.64 | 0.21 | 0.73 | 1.00 | 1.27 | 2.49 | NA | NA | 0.40 | 0.59 | NA | NA | NA | NA | 0.81 |
| UDP-glucose | ME917558 | 3.30 | 1.40 | 1.54 | 0.57 | 0.68 | 1.02 | NA | 0.83 | 0.91 | 0.50 | 1.30 | 0.56 | 0.48 | 0.44 | 0.32 | 0.77 | 1.44 | 0.41 | 0.61 | 0.95 | 1.37 | 0.34 | 1.26 | 1.36 | 1.45 | 1.15 | 0.90 | 1.33 | 1.78 | 0.76 | 0.59 | 0.64 | 1.30 | 1.29 | 0.80 | 1.00 | 0.64 | 1.94 | 0.84 | 0.23 | 0.97 | 1.47 | 1.26 | 1.69 | NA | 0.41 | 0.72 | 0.52 | 1.15 | NA | NA | NA | 0.82 |
| Arg-Leu-Thr-Tyr | ME917534 | 0.07 | NA | 0.10 | NA | NA | 0.55 | 2.20 | 0.16 | 0.50 | NA | NA | NA | 0.64 | 3.61 | 0.10 | NA | 0.16 | 1.76 | 0.08 | 0.11 | 2.81 | 0.03 | 2.19 | 0.40 | 0.40 | 0.11 | 0.18 | 0.34 | 2.38 | 0.52 | 0.56 | NA | 0.04 | 0.10 | NA | 2.21 | 0.07 | 0.07 | NA | 0.19 | 0.09 | NA | NA | NA | NA | 0.20 | 0.23 | NA | 3.49 | 2.96 | 3.14 | 3.09 | 3.09 |
| FA (18:3) | ME917921 | 0.71 | 0.45 | 0.67 | 0.39 | 0.48 | 0.98 | 1.31 | 0.73 | 0.93 | 0.52 | 0.54 | 0.47 | 0.93 | 1.92 | 0.70 | 0.55 | 0.89 | 1.43 | 0.77 | 0.89 | 2.22 | 0.76 | 1.60 | 1.11 | 0.88 | 0.65 | 0.74 | 0.81 | 1.64 | 0.93 | 1.11 | 0.74 | 0.72 | 0.68 | 0.62 | 1.63 | 0.52 | 0.65 | 0.50 | 0.67 | 0.52 | 0.49 | 0.50 | 0.52 | 0.42 | 0.73 | 0.77 | 0.49 | 2.35 | 3.46 | 3.53 | 3.54 | 2.71 |
| L-Serine | ME917698 | 0.55 | 0.40 | 0.66 | 0.34 | 0.37 | 0.91 | 2.24 | 0.47 | 0.98 | 0.38 | 0.45 | 0.41 | 0.98 | 2.40 | 0.53 | 0.36 | 0.65 | 1.57 | 0.41 | 0.45 | 2.71 | 0.46 | 2.24 | 1.03 | 0.73 | 0.55 | 0.51 | 0.38 | 2.32 | 1.00 | 1.06 | 0.39 | 0.50 | 0.46 | 0.47 | 2.56 | 0.43 | 0.59 | 0.34 | 0.53 | 0.43 | 0.33 | 0.40 | 0.38 | 0.41 | 0.58 | 0.62 | 0.35 | 2.61 | 3.90 | 3.26 | 3.63 | 3.44 |
| L-Proline | ME917987 | 0.10 | 0.06 | 0.07 | 0.04 | 0.32 | 0.95 | 1.37 | 0.49 | 1.09 | 0.38 | 0.45 | 0.33 | 0.37 | 0.95 | 0.19 | 0.22 | 0.45 | 1.83 | 0.40 | 0.40 | 4.69 | 0.76 | 3.98 | 1.41 | 0.37 | 0.20 | 0.37 | 0.42 | 1.79 | 0.90 | 1.55 | 0.44 | 0.91 | 0.82 | 0.85 | 4.72 | 0.13 | 0.23 | 0.16 | 0.16 | 0.08 | 0.07 | 0.09 | 0.08 | 0.21 | 0.66 | 0.67 | 0.33 | 2.59 | 3.31 | 3.43 | 3.38 | 2.76 |
| Dethiobiotin | ME917985 | 0.11 | 0.08 | 0.12 | 0.03 | 0.62 | 0.97 | 0.60 | 0.77 | 1.16 | 0.58 | 0.89 | 0.45 | 0.41 | 0.51 | 0.32 | 0.45 | 0.94 | 1.36 | 0.95 | 0.89 | 3.10 | 1.83 | 3.05 | 2.08 | 0.50 | 0.33 | 0.55 | 0.57 | 1.25 | 1.05 | 1.66 | 0.98 | 2.01 | 1.43 | 2.02 | 3.05 | 0.22 | 0.39 | 0.24 | 0.15 | 0.09 | 0.09 | 0.14 | 0.12 | 0.29 | 0.99 | 0.85 | 0.54 | 1.61 | 3.70 | 3.90 | 3.59 | 1.40 |
| Glycylproline | ME917977 | 0.11 | 0.08 | 0.12 | 0.03 | 0.63 | 0.98 | 0.60 | 0.77 | 1.17 | 0.56 | 0.90 | 0.45 | 0.42 | 0.49 | 0.33 | 0.46 | 0.95 | 1.27 | 0.86 | 0.89 | 3.12 | 1.84 | 3.08 | 2.10 | 0.45 | 0.33 | 0.52 | 0.58 | 1.26 | 1.05 | 1.67 | 0.99 | 2.02 | 1.44 | 2.03 | 3.08 | 0.22 | 0.39 | 0.24 | 0.15 | 0.09 | 0.09 | 0.14 | 0.12 | 0.29 | 1.00 | 0.86 | 0.55 | 1.51 | 3.73 | 3.93 | 3.62 | 1.41 |
| 7,8-H2pterin-6-ylmethyl-l-(4-aminophenyl)-1-deoxy-D-ribitol | ME917853 | NA | NA | NA | NA | NA | NA | 0.56 | 0.67 | NA | NA | 1.19 | 0.91 | NA | NA | 0.43 | 0.34 | NA | NA | 0.32 | 0.66 | NA | NA | 0.94 | 0.84 | NA | NA | 0.58 | 0.44 | NA | NA | 0.59 | 0.59 | NA | NA | 1.01 | 0.80 | NA | NA | 0.52 | 0.50 | NA | NA | 0.46 | 0.51 | NA | NA | 1.05 | 1.25 | 1.83 | 3.28 | 3.11 | 3.18 | 0.42 |
| (E)-Glutaconate | ME917566 | 0.36 | 0.47 | 0.43 | NA | 0.63 | 1.72 | 0.49 | 0.18 | 0.83 | 0.61 | 0.35 | 0.22 | 1.82 | 1.18 | 0.89 | NA | 1.45 | 1.17 | NA | 0.60 | 2.59 | 1.25 | 2.40 | 0.53 | 1.55 | 0.92 | 0.64 | NA | 1.31 | 0.80 | 0.56 | 0.34 | 1.42 | 0.58 | 0.63 | 0.41 | 0.58 | 0.82 | 0.58 | 0.61 | 0.92 | 0.47 | 0.39 | NA | 0.72 | 0.39 | 0.38 | 0.43 | 2.99 | 3.68 | 2.89 | 1.96 | 0.85 |
| 4-Oxoproline | ME917920 | 0.45 | 0.57 | 0.39 | 0.31 | 0.33 | 0.42 | 0.42 | 0.37 | 0.56 | 0.36 | 0.33 | 0.33 | 1.42 | 1.46 | 1.67 | 1.28 | 0.83 | 1.03 | 0.77 | 0.91 | 0.57 | 0.72 | 0.62 | 0.47 | 1.27 | 1.16 | 1.35 | 1.01 | 0.62 | 0.70 | 0.74 | 0.87 | 0.69 | 0.48 | 0.44 | 0.76 | 0.48 | 0.49 | 0.58 | 0.46 | 0.82 | 1.16 | 0.93 | 1.49 | 0.35 | 0.66 | 0.70 | 0.39 | 1.23 | 5.75 | 5.51 | 5.48 | 0.83 |
| Deamino-NAD+ | ME917654 | 0.15 | 0.14 | 0.22 | 0.42 | 0.57 | 0.53 | 0.28 | 0.34 | 0.79 | 0.52 | 0.64 | 0.46 | 0.61 | 0.53 | 0.83 | 0.86 | 1.16 | 1.52 | 1.49 | 1.18 | 1.68 | 2.48 | 2.03 | 1.86 | 0.66 | 0.32 | 0.98 | 0.69 | 1.35 | 1.41 | 2.12 | 1.98 | 2.06 | 1.12 | 1.52 | 1.77 | 0.17 | 0.21 | 0.25 | 0.19 | 0.13 | 0.38 | 0.58 | 0.52 | 0.59 | 0.57 | 0.78 | 0.52 | 2.11 | 4.04 | 3.84 | 4.10 | 0.83 |
| (R,R)-Tartaric acid | ME917631 | 0.28 | 0.15 | 0.17 | 0.07 | 0.25 | 0.39 | 0.26 | 0.31 | 0.29 | 0.25 | 0.53 | 0.31 | 1.44 | 0.82 | 1.14 | 1.43 | 1.77 | 1.43 | 1.76 | 1.58 | 1.82 | 1.97 | 2.35 | 2.02 | 0.87 | 0.56 | 1.10 | 0.95 | 1.12 | 0.95 | 1.67 | 1.58 | 1.47 | 0.61 | 1.38 | 1.56 | 0.14 | 0.32 | 0.23 | 0.13 | 0.17 | 0.26 | 0.39 | 0.26 | 0.20 | 0.45 | 0.45 | 0.40 | 2.58 | 5.04 | 4.70 | 4.57 | 0.91 |
| AMP | ME917982 | 0.22 | 0.11 | 0.11 | 0.05 | 0.24 | 0.31 | 0.23 | 0.30 | 0.30 | 0.23 | 0.52 | 0.30 | 1.45 | 0.84 | 1.08 | 1.59 | 1.64 | 1.72 | 1.82 | 1.58 | 1.97 | 2.07 | 2.51 | 2.10 | 0.89 | 0.59 | 1.08 | 0.93 | 1.21 | 1.11 | 1.77 | 1.66 | 1.43 | 0.60 | 1.39 | 1.46 | 0.12 | 0.27 | 0.23 | 0.11 | 0.17 | 0.23 | 0.37 | 0.26 | 0.09 | 0.43 | 0.50 | 0.38 | 1.63 | 3.67 | 3.64 | 3.54 | 0.94 |
| L-Leucine | ME917983 | 0.23 | 0.11 | 0.12 | 0.05 | 0.25 | 0.33 | 0.24 | 0.31 | 0.32 | 0.23 | 0.53 | 0.31 | 1.50 | 0.86 | 1.12 | 1.64 | 1.70 | 1.78 | 1.88 | 1.64 | 1.72 | 1.82 | 2.25 | 2.17 | 0.91 | 0.61 | 1.11 | 0.96 | 1.08 | 0.92 | 1.83 | 1.39 | 1.48 | 0.62 | 1.43 | 1.51 | 0.13 | 0.28 | 0.24 | 0.11 | 0.17 | 0.24 | 0.38 | 0.27 | 0.19 | 0.45 | 0.52 | 0.40 | 2.27 | 4.28 | 4.10 | 4.04 | 0.97 |
| Leucyl-leucine | ME917924 | 0.09 | 0.11 | 0.05 | 0.03 | 0.80 | 1.00 | 0.53 | 0.59 | 0.91 | 0.67 | 0.63 | 0.53 | 0.58 | 0.39 | 0.41 | 0.40 | 1.49 | 1.33 | 1.09 | 1.21 | 1.21 | 1.55 | 1.11 | 1.02 | 0.64 | 0.51 | 0.55 | 0.43 | 1.46 | 1.50 | 1.68 | 1.53 | 1.88 | 1.37 | 1.55 | 1.42 | 0.28 | 0.28 | 0.27 | 0.20 | 0.04 | 0.03 | 0.04 | NA | 0.60 | 1.19 | 0.75 | 0.61 | 1.46 | 4.48 | 4.39 | 4.31 | 0.84 |
| (2S,4S)-Monatin | ME917592 | NA | NA | NA | NA | NA | 0.15 | NA | NA | 0.14 | NA | 0.18 | NA | 0.78 | 0.45 | 0.71 | 0.66 | 1.20 | 1.10 | 1.19 | 1.07 | 1.07 | 1.21 | 1.33 | 0.96 | 0.63 | 0.44 | 0.68 | 0.69 | 0.85 | 0.79 | 1.19 | 0.89 | 0.87 | 0.37 | 0.57 | 0.74 | NA | NA | NA | NA | NA | 0.12 | 0.18 | 0.22 | NA | 0.21 | 0.31 | NA | 1.66 | 4.68 | 4.33 | 3.86 | 0.56 |
| Ile-Val | ME917797 | NA | 0.32 | NA | NA | 0.47 | 0.43 | 0.55 | 0.44 | 0.59 | 0.45 | 0.52 | 0.42 | 1.04 | 0.63 | 0.56 | 0.88 | 1.02 | 0.95 | 1.04 | 0.86 | 0.74 | 1.78 | 0.96 | 1.43 | 0.53 | 0.55 | 0.88 | 0.63 | 0.73 | 0.97 | 0.88 | 0.96 | 0.83 | 0.52 | 0.75 | 0.81 | NA | 0.43 | 0.37 | NA | 0.31 | 0.34 | NA | 0.46 | NA | 0.53 | 0.40 | 0.48 | 3.17 | 5.04 | 4.95 | 4.49 | 0.60 |
| FA hydroxy(16:0) | ME917663 | 0.61 | 0.41 | 0.37 | 0.26 | 0.48 | 0.79 | 0.40 | 0.56 | 0.59 | 0.63 | 0.76 | 0.55 | 0.79 | 0.65 | 0.65 | 0.69 | 1.58 | 1.06 | 1.15 | 1.45 | 1.27 | 1.61 | 1.74 | 1.47 | 0.69 | 0.56 | 0.72 | 0.65 | 0.77 | 1.03 | 1.40 | 1.22 | 1.65 | 1.00 | 1.25 | 1.31 | 0.37 | 0.56 | 0.39 | 0.28 | 0.35 | 0.41 | 0.53 | 0.45 | 0.31 | 0.60 | 0.64 | 0.34 | 2.11 | 4.33 | 4.18 | 4.31 | 0.98 |
| 2-oxopimelate | ME917817 | 0.35 | 0.32 | 0.33 | NA | 0.35 | 0.72 | 0.27 | 0.47 | 0.72 | 0.38 | 0.62 | 0.34 | 1.16 | 0.92 | 0.94 | 0.69 | 1.66 | 1.54 | 1.17 | 1.46 | 1.13 | 1.18 | 1.30 | 1.02 | 0.97 | 0.87 | 0.97 | 0.52 | 1.13 | 1.09 | 1.41 | 0.81 | 1.31 | 0.71 | 0.95 | 0.91 | 0.28 | 0.38 | 0.30 | NA | 0.27 | 0.54 | 0.43 | 0.45 | 0.31 | 0.78 | 0.35 | 0.40 | 1.56 | 5.15 | 4.54 | 4.63 | 0.79 |
| Pseudouridine | ME917762 | 0.29 | 0.15 | 0.25 | NA | 0.56 | 0.63 | 0.62 | 0.37 | 0.56 | 0.45 | 0.71 | 0.54 | 1.05 | 0.90 | 0.97 | 1.12 | 1.30 | 1.53 | 1.29 | 1.25 | 1.30 | 1.39 | 1.01 | 0.77 | 0.86 | 0.56 | 0.87 | 0.75 | 0.96 | 0.76 | 1.53 | 0.92 | 0.86 | 0.38 | 0.58 | 0.65 | NA | 0.17 | 0.30 | NA | 0.22 | 0.36 | 0.35 | 0.37 | 0.29 | 0.52 | 0.38 | 0.20 | 3.23 | 4.74 | 4.59 | 4.76 | 0.85 |
| [FA oxo(14:0)] 3-oxo-tetradecanoic acid | ME917732 | 0.26 | 0.30 | 0.23 | NA | 0.42 | 0.67 | 0.32 | 0.31 | 0.66 | 0.45 | 0.53 | 0.39 | 0.73 | 0.93 | 0.82 | 1.03 | 1.34 | 1.25 | 1.52 | 1.19 | 1.16 | 1.26 | 1.23 | 1.07 | 0.70 | 0.62 | 0.90 | 0.86 | 1.09 | 1.01 | 1.35 | 1.13 | 1.27 | 0.89 | 0.98 | 1.14 | 0.19 | 0.49 | 0.19 | NA | 0.29 | 0.40 | 0.52 | 0.52 | 0.32 | 0.72 | 0.51 | 0.30 | 2.49 | 4.53 | 3.69 | 4.96 | 0.83 |
| Indolelactate | ME917882 | 0.37 | 0.21 | 0.19 | NA | 0.31 | 0.70 | 0.34 | 0.46 | 0.56 | 0.32 | 0.55 | 0.26 | 0.99 | 0.99 | 1.16 | 1.16 | 1.18 | 1.48 | 1.15 | 1.22 | 0.94 | 0.98 | 0.94 | 1.04 | 1.00 | 0.82 | 1.08 | 1.17 | 1.12 | 1.08 | 1.47 | 1.08 | 0.86 | 0.61 | 0.81 | 0.61 | NA | 0.48 | 0.29 | NA | 0.25 | 0.38 | 0.62 | 0.35 | NA | 0.72 | 0.48 | NA | 2.10 | 4.04 | 4.01 | 4.20 | 0.89 |
| Lys-Ala-Pro | ME917553 | 0.42 | 0.31 | 0.34 | 0.19 | 0.53 | 0.67 | 0.48 | 0.49 | 0.51 | 0.42 | 0.59 | 0.37 | 1.13 | 0.94 | 1.11 | 1.12 | 1.37 | 1.43 | 1.40 | 1.36 | 1.06 | 1.12 | 1.09 | 1.02 | 1.14 | 0.87 | 1.19 | 1.06 | 1.03 | 0.96 | 1.34 | 1.16 | 0.83 | 0.57 | 0.72 | 0.76 | 0.29 | 0.43 | 0.38 | 0.23 | 0.31 | 0.45 | 0.58 | 0.52 | 0.31 | 0.56 | 0.52 | 0.34 | 2.37 | 4.44 | 4.58 | 4.65 | 0.92 |
| Dicyclohexyl disulfide | ME917828 | 0.88 | 0.98 | 0.58 | NA | NA | 1.09 | NA | NA | 0.66 | NA | 0.56 | NA | 0.77 | 0.68 | 0.57 | 0.59 | 0.81 | 0.87 | 0.67 | 0.60 | 0.91 | 0.98 | 1.20 | 1.52 | 0.56 | 0.51 | 0.84 | 0.75 | 0.80 | 0.60 | 0.70 | 0.76 | 1.37 | 0.59 | 0.56 | 1.28 | NA | 0.56 | 0.38 | NA | 0.46 | 0.62 | 0.52 | 0.57 | NA | 0.59 | 0.50 | NA | 1.74 | 3.94 | 3.68 | 4.23 | 0.98 |
| UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminoheptanedioate-D-alanine | ME917857 | 1.60 | 0.67 | 0.61 | NA | NA | 0.45 | NA | NA | 0.53 | NA | 0.80 | NA | 0.86 | NA | 0.53 | 0.62 | 1.10 | 0.69 | 0.65 | 1.05 | 1.51 | 0.70 | 1.12 | 1.35 | 0.89 | 0.64 | 0.48 | 0.73 | 1.30 | 0.57 | 1.16 | 0.61 | 1.09 | 1.03 | 0.50 | 0.98 | NA | 0.57 | 0.38 | NA | 0.35 | 0.67 | 0.88 | 0.61 | NA | NA | 0.44 | NA | 0.93 | 3.47 | 3.76 | 3.49 | 0.66 |
| (S)-AMPA | ME917930 | 0.94 | 0.75 | 0.60 | 0.40 | 0.59 | 0.86 | 0.44 | 0.73 | 1.05 | 0.73 | 1.18 | 0.90 | 0.55 | 0.43 | 0.36 | 0.51 | 0.63 | 0.69 | 0.74 | 0.81 | 0.77 | 0.99 | 1.14 | 1.63 | 0.55 | 0.59 | 0.52 | 0.51 | 0.72 | 0.50 | 1.05 | 0.88 | 2.20 | 1.41 | 1.55 | 1.74 | 0.41 | 1.05 | 0.62 | 0.35 | 0.51 | 0.61 | 0.59 | 0.86 | 0.35 | 0.69 | 0.97 | 0.73 | 1.76 | 4.44 | 4.49 | 4.25 | 0.70 |
| Daidzin | ME917948 | 0.44 | 0.62 | 0.48 | 0.44 | 0.80 | 0.81 | 0.63 | 0.54 | 0.79 | 0.79 | 0.89 | 0.82 | 1.07 | 0.73 | 0.89 | 0.75 | 0.83 | 0.89 | 0.85 | 0.81 | 0.51 | 1.24 | 0.98 | 0.71 | 1.02 | 0.71 | 1.02 | 0.71 | 0.91 | 0.87 | 0.98 | 0.98 | 1.29 | 1.06 | 1.03 | 1.15 | 0.71 | 0.68 | 0.79 | 0.63 | 0.63 | 0.78 | 0.76 | 0.64 | 0.43 | 1.10 | 0.94 | 0.71 | 2.20 | 3.62 | 3.68 | 3.64 | 1.01 |
| Ile-Val-Pro-Ser | ME918006 | 0.85 | 0.82 | 0.75 | 0.63 | 0.93 | 0.91 | 0.74 | 0.87 | 0.88 | 0.91 | 0.85 | 0.81 | 0.92 | 0.82 | 0.79 | 0.81 | 0.92 | 0.96 | 0.68 | 0.89 | 0.72 | 0.86 | 0.83 | 0.96 | 0.94 | 0.95 | 0.78 | 0.89 | 0.90 | 0.90 | 0.82 | 0.84 | 0.97 | 0.94 | 0.88 | 0.91 | 0.84 | 0.87 | 0.92 | 0.72 | 1.01 | 1.03 | 0.96 | 0.99 | 0.70 | 0.89 | 0.91 | 0.79 | 1.48 | 2.92 | 3.25 | 2.96 | 0.94 |
| PA(32:1) | ME917642 | 0.93 | 0.95 | 0.79 | 0.45 | 0.94 | 1.11 | 0.60 | 0.69 | 0.90 | 0.90 | 0.70 | 0.75 | 1.02 | 1.00 | 0.63 | 0.71 | 1.36 | 0.76 | 0.85 | 1.20 | 0.67 | 1.32 | 0.83 | 0.66 | 1.08 | 1.16 | 0.59 | 0.71 | 0.87 | 1.24 | 0.70 | 0.71 | 1.21 | 1.21 | 0.58 | 1.18 | 0.90 | 1.13 | 0.98 | 0.80 | 0.78 | 0.95 | 1.10 | 1.14 | 0.59 | 0.51 | 0.82 | 1.04 | 2.19 | 2.71 | 3.41 | 2.64 | 0.99 |
| d-biotin d-sulfoxide | ME917919 | 0.30 | 0.28 | 0.38 | 0.08 | 0.88 | 0.93 | 0.56 | 0.66 | 1.10 | 0.75 | 1.02 | 0.75 | 0.51 | 0.40 | 0.47 | 0.58 | 1.02 | 0.86 | 0.73 | 0.69 | 1.11 | 1.14 | 1.40 | 1.44 | 1.04 | 0.85 | 0.82 | 0.81 | 1.20 | 1.21 | 1.09 | 0.95 | 2.22 | 1.37 | 1.45 | 1.64 | 0.56 | 1.04 | 0.69 | 0.44 | 0.36 | 0.33 | 0.30 | 0.45 | 0.62 | 1.31 | 0.96 | 0.89 | 1.26 | 3.31 | 3.47 | 3.37 | 0.92 |
| FA methyl(14:0) | ME917760 | 1.26 | 0.83 | 0.73 | 0.59 | 0.73 | 0.88 | 0.52 | 0.83 | 1.23 | 0.76 | 1.03 | 1.03 | 0.86 | 0.61 | 0.81 | 0.79 | 0.87 | 0.82 | 0.92 | 0.95 | 1.07 | 1.04 | 1.46 | 1.37 | 0.73 | 0.79 | 0.95 | 0.72 | 1.16 | 0.76 | 0.96 | 1.20 | 1.85 | 0.87 | 1.42 | 1.48 | 0.57 | 0.93 | 0.73 | 0.69 | 0.67 | 0.90 | 0.75 | 0.86 | 0.56 | 0.68 | 0.92 | 0.82 | 1.41 | 3.53 | 3.76 | 2.73 | 1.03 |
| L-Lysine | ME917990 | 0.97 | 0.67 | 0.64 | 0.35 | 0.58 | 1.00 | 0.31 | 0.79 | 0.94 | 0.68 | 1.02 | 0.68 | 0.73 | 0.64 | 0.54 | 0.79 | 1.30 | 0.88 | 0.99 | 1.11 | 1.15 | 1.49 | 1.68 | 1.93 | 0.74 | 0.67 | 0.56 | 0.75 | 1.12 | 0.83 | 1.12 | 1.06 | 2.03 | 1.38 | 1.54 | 1.77 | 0.40 | 0.92 | 0.56 | 0.32 | 0.45 | 0.69 | 0.69 | 0.96 | 0.32 | 0.72 | 0.85 | 0.47 | 1.58 | 2.85 | 2.79 | 2.90 | 1.09 |
| Ile-Lys | ME917806 | NA | 0.38 | NA | NA | NA | 0.49 | NA | 0.41 | NA | NA | 0.34 | 0.29 | 1.49 | NA | NA | 0.48 | NA | 0.66 | 2.57 | 0.80 | NA | 0.56 | 1.06 | 1.83 | NA | NA | 0.36 | 0.76 | 0.47 | 0.51 | 1.78 | 0.78 | 1.66 | 0.46 | 0.64 | 1.09 | NA | NA | 0.34 | NA | NA | 0.91 | NA | 2.87 | NA | NA | 0.93 | NA | 1.42 | 1.33 | 2.00 | 1.75 | 0.59 |
| L-Cladinose | ME917759 | 0.54 | 1.32 | 0.74 | NA | 0.94 | 0.59 | NA | 0.26 | 0.54 | 0.47 | 0.47 | 0.64 | 2.45 | 2.48 | 3.00 | 1.87 | 0.70 | 1.19 | 1.24 | 0.83 | 0.64 | 0.75 | 0.85 | 0.72 | 1.25 | 1.91 | 1.18 | 1.28 | 0.58 | 0.98 | 0.59 | 0.69 | 0.79 | 0.94 | 0.76 | 0.85 | 0.32 | 0.38 | 0.65 | NA | 1.51 | 0.91 | 0.62 | 1.64 | 2.04 | 1.10 | 1.71 | 0.94 | 1.68 | 0.91 | 1.22 | 0.59 | 0.65 |
| S-Adenosyl-L-homocysteine | ME917968 | 0.29 | 0.44 | 0.30 | 0.27 | 0.15 | 0.16 | 0.20 | 0.16 | 0.25 | 0.17 | 0.18 | 0.18 | 2.33 | 2.25 | 2.88 | 2.29 | 1.36 | 1.58 | 1.25 | 1.50 | 0.83 | 0.91 | 0.81 | 0.64 | 2.31 | 2.01 | 2.20 | 1.76 | 1.14 | 1.16 | 1.21 | 1.26 | 0.73 | 0.50 | 0.37 | 0.76 | 0.22 | 0.20 | 0.26 | 0.20 | 1.38 | 1.90 | 1.67 | 2.66 | 0.54 | 0.83 | 0.70 | 0.55 | 1.37 | 1.55 | 1.59 | 1.52 | 1.04 |
| Urocanate | ME917972 | 0.27 | 0.47 | 0.26 | 0.25 | 0.15 | 0.17 | 0.19 | 0.16 | 0.23 | 0.18 | 0.19 | 0.17 | 2.29 | 2.31 | 2.74 | 2.22 | 1.34 | 1.52 | 1.33 | 1.46 | 0.80 | 0.94 | 0.80 | 0.64 | 2.29 | 1.94 | 2.18 | 1.60 | 1.13 | 1.11 | 1.17 | 1.23 | 0.75 | 0.51 | 0.39 | 0.73 | 0.21 | 0.20 | 0.28 | 0.20 | 1.38 | 2.01 | 1.65 | 2.49 | 0.52 | 0.82 | 0.71 | 0.53 | 1.23 | 1.52 | 1.54 | 1.53 | 1.04 |
| His-Leu | ME917988 | NA | 1.15 | 0.30 | NA | 0.28 | 0.34 | 0.55 | 0.33 | 0.31 | 0.44 | 0.27 | 0.32 | 2.26 | 1.69 | 2.70 | 2.89 | 0.24 | 1.38 | 3.01 | 1.30 | 0.53 | 1.86 | 1.20 | 0.65 | 1.07 | 1.78 | 3.01 | 1.66 | 0.12 | 0.98 | 1.29 | 1.85 | 0.14 | 0.44 | 0.50 | 0.49 | 0.42 | NA | 0.70 | NA | 0.64 | 0.45 | 0.48 | 0.82 | NA | 0.18 | 0.79 | NA | 1.05 | 0.92 | 0.92 | 1.33 | 0.97 |
| L-Aspartate | ME917880 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 2.48 | 1.24 | 2.03 | 2.15 | 0.23 | 0.83 | 2.00 | 0.98 | 0.56 | 1.36 | 0.52 | 0.25 | 1.03 | 1.31 | 2.22 | 1.60 | 0.45 | 0.90 | 0.82 | 1.36 | 0.09 | NA | NA | 0.24 | NA | NA | 0.18 | 0.15 | 0.36 | 0.54 | 0.76 | 0.82 | NA | 0.10 | 0.17 | NA | 1.21 | 1.63 | 1.87 | 1.74 | 0.84 |
| FA hydroxy(18:1)] | ME917589 | 0.07 | 0.28 | 0.13 | 0.40 | 0.26 | 0.13 | 0.24 | 0.18 | 0.31 | 0.29 | 0.19 | 0.27 | 3.30 | 2.08 | 2.83 | 3.00 | 0.35 | 1.79 | 3.14 | 1.30 | 1.17 | 1.77 | 0.69 | 0.38 | 1.46 | 2.28 | 2.80 | 2.25 | 0.78 | 1.98 | 1.31 | 2.05 | 0.27 | 0.31 | 0.32 | 0.29 | 0.19 | 0.02 | 0.25 | 0.29 | 0.54 | 0.62 | 0.91 | 1.36 | 0.52 | 0.24 | 0.24 | 0.12 | 3.18 | 0.80 | 0.90 | 1.11 | 1.08 |
| CDP-DG(16:0/18:2(9Z,12Z)) | ME917537 | NA | 1.02 | 0.14 | 1.49 | 0.36 | 0.19 | 0.71 | 0.18 | 0.34 | 0.42 | 0.13 | 0.25 | 3.49 | 2.25 | 3.65 | 3.15 | 0.15 | 1.49 | 4.83 | 0.99 | 0.48 | 2.16 | 0.99 | 0.31 | 0.87 | 1.88 | 3.37 | 1.34 | 0.12 | 1.31 | 1.58 | 2.29 | 0.12 | 0.27 | 0.27 | 0.24 | 0.27 | 0.05 | 0.42 | 0.67 | 0.46 | 0.28 | 0.27 | 0.65 | 0.90 | 0.19 | 0.55 | 0.07 | 1.59 | 0.72 | 0.76 | 0.67 | 0.66 |
| Succinate | ME917656 | NA | 0.61 | 0.15 | 0.67 | 0.17 | NA | 0.30 | 0.15 | 0.24 | 0.25 | 0.15 | NA | 3.88 | 1.63 | 3.41 | 3.26 | 0.18 | 1.53 | 3.23 | 0.97 | 1.13 | 2.37 | 0.47 | 0.19 | 1.05 | 2.07 | 2.88 | 1.80 | 0.65 | 1.98 | 1.47 | 2.67 | 0.14 | 0.34 | 0.21 | 0.21 | 0.13 | 0.05 | 0.28 | 0.39 | 0.52 | 0.43 | 0.58 | 1.77 | 0.64 | 0.18 | 0.27 | 0.09 | NA | 0.79 | 0.86 | 0.92 | 0.71 |
| Formyl-5-hydroxykynurenamine | ME918024 | NA | 0.09 | 0.06 | 0.22 | 0.18 | 0.11 | 0.19 | 0.13 | 0.22 | 0.22 | 0.12 | 0.24 | 3.71 | 1.78 | 3.63 | 4.01 | 0.37 | 1.81 | 3.14 | 1.34 | 1.23 | 1.67 | 0.63 | 0.26 | 1.65 | 2.37 | 3.23 | 2.50 | 0.74 | 1.79 | 1.39 | 2.17 | 0.18 | 0.22 | 0.19 | 0.26 | 0.17 | 0.07 | 0.20 | 0.18 | 0.60 | 0.83 | 1.12 | 1.46 | 0.32 | 0.18 | 0.21 | 0.07 | NA | 0.87 | 0.90 | 0.91 | 0.86 |
| Glu-Ala-Phe | ME917567 | 0.06 | 0.24 | 0.12 | 0.37 | 0.26 | 0.18 | 0.36 | 0.20 | 0.33 | 0.37 | 0.19 | 0.32 | 3.61 | 2.16 | 3.68 | 3.16 | 0.47 | 1.74 | 3.58 | 1.28 | 1.22 | 1.87 | 0.66 | 0.31 | 1.63 | 2.19 | 3.29 | 2.31 | 0.79 | 1.81 | 1.33 | 2.17 | 0.29 | 0.30 | 0.31 | 0.34 | 0.21 | 0.13 | 0.27 | 0.28 | 0.59 | 0.55 | 0.84 | 1.22 | 0.54 | 0.24 | 0.26 | 0.15 | NA | 0.79 | 0.76 | 0.86 | 0.82 |
| Dihydroclavaminic acid | ME917717 | 0.18 | NA | NA | NA | 0.28 | 0.54 | 0.60 | 0.47 | 0.52 | 0.24 | 0.56 | 0.47 | 2.53 | 2.15 | 1.14 | 1.43 | 1.33 | 1.61 | 4.20 | 1.50 | 1.19 | 1.60 | 0.79 | 1.19 | 0.77 | 0.82 | 1.39 | 0.94 | 1.07 | 0.89 | 1.16 | 1.67 | 1.03 | 0.73 | 1.06 | 0.91 | 0.21 | 0.49 | 0.30 | 0.49 | NA | 0.18 | 0.31 | 0.74 | NA | 0.47 | 0.46 | 0.41 | 2.28 | 1.32 | 1.01 | 1.31 | 1.07 |
| L-Glutamate | ME917915 | 0.15 | 0.10 | NA | NA | 0.41 | 0.51 | 0.64 | 0.26 | 0.31 | 0.30 | 0.44 | 0.13 | 2.27 | 2.59 | 2.18 | 1.95 | 1.53 | 1.47 | 4.16 | 1.63 | 1.18 | 2.08 | 1.29 | 1.07 | 1.15 | 0.88 | 2.95 | 1.60 | 0.77 | 0.92 | 1.74 | 1.43 | 0.93 | 0.44 | 0.77 | 0.67 | 0.11 | 0.32 | 0.33 | 0.40 | NA | 0.27 | 0.55 | 0.67 | 0.22 | 0.28 | 0.33 | 0.31 | 1.51 | 1.03 | 1.26 | 1.09 | 0.43 |
| Picolinamide | ME918028 | 0.20 | 0.10 | 0.16 | NA | 0.41 | 0.56 | 0.64 | 0.28 | 0.31 | 0.30 | 0.47 | 0.18 | 2.25 | 2.57 | 2.17 | 1.94 | 1.52 | 1.46 | 4.13 | 1.76 | 1.24 | 0.94 | 0.97 | 1.38 | 1.15 | 0.88 | 2.93 | 1.59 | 0.86 | 0.92 | 1.73 | 1.42 | 0.93 | 0.43 | 0.77 | 0.71 | 0.15 | 0.32 | 0.33 | 0.40 | NA | 0.31 | 0.62 | 0.83 | 0.22 | 0.37 | 0.33 | 0.31 | 1.96 | 1.22 | 1.11 | 1.31 | 0.97 |
| sn-glycero-3-Phospho-1-inositol | ME917584 | 0.13 | 0.10 | 0.12 | 0.04 | 0.14 | 0.27 | 0.15 | 0.14 | 0.27 | 0.16 | 0.18 | 0.11 | 2.41 | 2.13 | 2.21 | 2.04 | 2.59 | 3.59 | 1.54 | 1.32 | 1.36 | 1.10 | 1.43 | 1.02 | 2.30 | 1.99 | 3.06 | 2.06 | 0.98 | 1.04 | 1.14 | 1.50 | 0.92 | 0.50 | 0.89 | 0.90 | 0.17 | 0.28 | 0.18 | 0.17 | 0.20 | 0.22 | 0.20 | 0.16 | 0.16 | 1.51 | 0.28 | 0.22 | 1.24 | 1.74 | 1.61 | 1.74 | 1.11 |
| Pyridoxamine phosphate | ME917965 | 0.14 | 0.11 | 0.27 | 0.10 | 0.22 | 0.41 | 0.23 | 0.24 | 0.34 | 0.23 | 0.32 | 0.15 | 2.10 | 1.84 | 3.43 | 2.77 | 2.29 | 2.33 | 2.21 | 2.08 | 1.87 | 2.26 | 1.97 | 1.33 | 1.42 | 0.87 | 2.17 | 1.38 | 1.03 | 0.97 | 1.25 | 1.10 | 0.88 | 0.40 | 0.70 | 0.54 | 0.12 | 0.24 | 0.23 | 0.13 | 0.20 | 0.41 | 0.55 | 0.71 | 0.19 | 0.40 | 0.37 | 0.25 | 1.28 | 1.65 | 1.61 | 1.68 | 1.01 |
| Casimiroedine | ME917951 | 0.09 | 0.07 | 0.12 | 0.05 | 0.12 | 0.20 | 0.15 | 0.12 | 0.22 | 0.11 | 0.18 | 0.08 | 2.76 | 2.45 | 3.33 | 2.91 | 2.78 | 3.09 | 2.35 | 2.00 | 2.37 | 1.74 | 1.84 | 1.26 | 1.60 | 1.29 | 2.29 | 1.80 | 1.01 | 0.98 | 1.25 | 0.91 | 0.54 | 0.25 | 0.44 | 0.41 | 0.08 | 0.11 | 0.11 | 0.07 | 0.26 | 0.41 | 0.52 | 0.41 | 0.13 | 0.27 | 0.22 | 0.12 | 1.19 | 1.59 | 1.65 | 1.69 | 1.05 |
| Val-Pro-Arg | ME917949 | 0.09 | 0.07 | 0.12 | 0.04 | 0.13 | 0.18 | 0.18 | 0.12 | 0.19 | 0.13 | 0.19 | 0.07 | 2.71 | 2.48 | 3.34 | 3.01 | 2.68 | 3.10 | 2.32 | 2.11 | 2.40 | 1.77 | 1.90 | 1.19 | 1.62 | 1.22 | 2.26 | 1.84 | 1.05 | 1.01 | 1.20 | 0.92 | 0.53 | 0.25 | 0.39 | 0.44 | 0.08 | 0.10 | 0.11 | 0.08 | 0.29 | 0.36 | 0.51 | 0.40 | 0.13 | 0.30 | 0.21 | 0.11 | 1.20 | 1.62 | 1.58 | 1.56 | 1.15 |
| N6-(1,2-Dicarboxyethyl)-AMP | ME917538 | 0.23 | NA | 0.47 | NA | 0.07 | 0.25 | 0.30 | 0.31 | 0.23 | 0.15 | 0.34 | 0.29 | 2.49 | 2.26 | 1.95 | 2.39 | 1.90 | 2.85 | 2.16 | 1.53 | 2.47 | 1.90 | 2.58 | 2.11 | 1.11 | 0.71 | 1.16 | 1.20 | 0.67 | 0.56 | 1.19 | 0.94 | 0.58 | 0.31 | 0.87 | 0.98 | NA | 0.15 | 0.22 | 0.09 | 0.17 | 0.15 | 0.35 | 0.32 | NA | 0.32 | 0.57 | 0.37 | 1.27 | 1.40 | 1.51 | 1.30 | 1.30 |
| Harman | ME917955 | 0.28 | 0.26 | 0.44 | 0.13 | 0.23 | 0.37 | 0.33 | 0.26 | 0.35 | 0.22 | 0.42 | 0.17 | 2.06 | 1.41 | 2.10 | 2.24 | 2.03 | 2.73 | 3.13 | 2.09 | 2.38 | 1.91 | 2.55 | 1.67 | 1.25 | 0.93 | 1.80 | 1.30 | 0.91 | 0.76 | 1.47 | 1.17 | 0.81 | 0.40 | 0.73 | 0.79 | 0.18 | 0.24 | 0.27 | 0.15 | 0.32 | 0.47 | 0.65 | 0.62 | 0.19 | 0.40 | 0.38 | 0.19 | 1.15 | 1.54 | 1.51 | 1.57 | 1.07 |
| NAD+ | ME917954 | 0.28 | 0.26 | 0.44 | 0.13 | 0.23 | 0.36 | 0.33 | 0.26 | 0.35 | 0.22 | 0.41 | 0.17 | 2.12 | 1.52 | 2.41 | 2.22 | 2.01 | 2.71 | 3.10 | 2.07 | 2.36 | 1.90 | 2.53 | 1.65 | 1.24 | 0.92 | 1.79 | 1.29 | 0.90 | 0.76 | 1.46 | 1.16 | 0.81 | 0.39 | 0.73 | 0.79 | 0.18 | 0.24 | 0.27 | 0.15 | 0.31 | 0.47 | 0.64 | 0.62 | 0.19 | 0.40 | 0.38 | 0.19 | 1.20 | 1.53 | 1.48 | 1.43 | 1.06 |
| Pyrimidine nucleoside | ME917718 | 0.19 | 0.57 | 0.22 | NA | 0.71 | 0.77 | 1.58 | 0.50 | 0.60 | 0.72 | 0.46 | 0.33 | 2.43 | 2.45 | 2.45 | 1.92 | 0.62 | 1.87 | 2.79 | 1.24 | 0.80 | 1.72 | 1.18 | 0.81 | 1.51 | 1.13 | 1.75 | 0.75 | 0.72 | 1.56 | 1.87 | 2.59 | 0.33 | 0.34 | 0.66 | 0.58 | 0.55 | 0.36 | 0.60 | 0.94 | 0.37 | 0.41 | 0.68 | 0.78 | 1.11 | 0.19 | 0.60 | 0.20 | NA | 0.80 | 0.97 | 0.87 | 0.86 |
| FA methyl(12:0) dodecanoic acid | ME917747 | 0.18 | 0.44 | 0.32 | 0.73 | 0.48 | 0.58 | 1.23 | 0.48 | 0.54 | 0.81 | 0.37 | 0.60 | 2.71 | 2.77 | 1.91 | 1.55 | 0.59 | 1.22 | 3.17 | 1.07 | 0.63 | 2.43 | 0.88 | 0.94 | 0.74 | 1.11 | 1.69 | 0.72 | 0.49 | 1.29 | 1.44 | 1.77 | 0.73 | 0.66 | 0.73 | 0.72 | 0.36 | 0.30 | 0.70 | 1.12 | 0.24 | 0.39 | 0.34 | 1.48 | 2.23 | 0.38 | 0.89 | 0.30 | 1.83 | 0.95 | 0.85 | 1.00 | 0.97 |
| N6-(L-1,3-Dicarboxypropyl)-L-lysine | ME918019 | NA | 0.42 | NA | NA | 0.60 | 0.43 | 1.42 | 0.51 | 0.93 | 0.33 | 0.37 | 1.08 | 0.99 | 2.70 | 1.13 | 1.64 | 0.34 | 1.10 | 2.94 | 1.02 | 0.64 | 1.86 | 0.82 | 0.60 | NA | 1.07 | 1.88 | 0.42 | 0.51 | 1.35 | 1.68 | 2.13 | 0.91 | 0.91 | 0.86 | 0.89 | NA | NA | NA | 0.66 | 0.52 | NA | NA | 1.31 | 2.09 | 0.58 | 1.33 | 0.23 | 0.83 | 0.36 | 0.36 | 0.38 | 0.87 |
| 4-Hydroxyhexan-3-one | ME917763 | 0.36 | 1.10 | 0.54 | 2.41 | 1.01 | 1.13 | 0.84 | 0.71 | 0.77 | 1.25 | 0.63 | 1.57 | 1.98 | 1.85 | 0.91 | 1.57 | 0.55 | 1.24 | 2.48 | 0.81 | 0.70 | 1.84 | 0.87 | 0.53 | 0.61 | 1.29 | 1.56 | 0.87 | 0.63 | 1.13 | 1.62 | 1.09 | 1.00 | 0.92 | 0.64 | 0.83 | 0.74 | 0.54 | 0.91 | 1.55 | 0.55 | 0.31 | 0.50 | 2.13 | 3.16 | 0.67 | 0.88 | 0.59 | 1.80 | 0.97 | 0.91 | 0.93 | 0.44 |
| indole-3-acetyl-valine | ME917838 | 0.07 | 0.45 | 0.11 | 1.70 | 0.75 | 0.61 | 1.26 | 0.58 | 0.67 | 0.90 | 0.85 | 2.38 | 1.44 | 1.88 | 1.53 | 1.24 | 0.41 | 0.83 | 2.02 | 0.68 | 0.28 | 1.09 | 1.17 | 1.10 | 0.44 | 1.06 | 1.93 | 0.78 | 0.34 | 0.83 | 0.98 | 1.28 | 1.02 | 1.51 | 0.95 | 1.04 | 0.12 | 0.19 | 0.29 | 0.98 | 0.89 | 0.49 | 0.10 | 1.63 | 3.51 | 0.80 | 2.48 | 1.07 | 1.34 | 0.65 | 0.74 | 0.67 | 0.89 |
| L-Tryptophan | ME917953 | 0.18 | 1.03 | 0.42 | 2.79 | 0.45 | 0.33 | 0.58 | 0.33 | 0.38 | 0.49 | 0.23 | 0.39 | 1.80 | 1.92 | 2.64 | 1.46 | 0.36 | 1.79 | 2.62 | 0.88 | 0.43 | 1.81 | 0.86 | 0.37 | 1.31 | 1.51 | 2.51 | 1.35 | 0.46 | 1.45 | 1.89 | 1.82 | 0.98 | 0.66 | 0.48 | 0.67 | 0.41 | 0.23 | 0.65 | 1.14 | 0.71 | 0.55 | 0.51 | 1.44 | 1.28 | 0.55 | 1.23 | 0.46 | 0.08 | 1.11 | 1.09 | 1.06 | 0.88 |
| D-Glucosamine | ME918023 | 0.32 | 0.81 | 0.37 | 1.25 | 0.43 | 0.46 | 1.18 | 0.55 | 0.68 | 0.75 | 0.36 | 0.84 | 2.67 | 2.07 | 2.59 | 2.35 | 0.28 | 0.89 | 1.95 | 0.60 | 0.28 | 1.10 | 0.55 | 0.47 | 1.01 | 1.48 | 3.42 | 1.26 | 0.37 | 0.73 | 0.85 | 2.05 | 0.38 | 0.49 | 0.42 | 0.52 | 0.45 | 0.35 | 0.99 | 1.57 | 0.43 | 0.42 | 0.55 | 3.54 | 1.05 | 0.16 | 0.78 | 0.12 | 1.74 | 0.95 | 1.12 | 0.96 | 1.03 |
| GMP | ME917895 | 0.42 | 0.55 | 0.38 | 0.59 | 0.53 | 0.65 | 1.18 | 0.66 | 0.62 | 0.73 | 0.39 | 0.71 | 2.69 | 1.94 | 2.08 | 2.25 | 0.50 | 0.99 | 2.71 | 1.04 | 0.53 | 1.62 | 0.87 | 0.62 | 1.09 | 1.25 | 2.55 | 1.34 | 0.44 | 0.77 | 1.13 | 1.89 | 0.42 | 0.60 | 0.46 | 0.66 | 0.56 | 0.37 | 0.85 | 1.40 | 0.75 | 0.44 | 0.60 | 2.10 | 1.13 | 0.33 | 0.93 | 0.30 | 1.68 | 0.95 | 1.03 | 0.87 | 0.91 |
| L-2-Aminoadipate 6-semialdehyde | ME918022 | NA | 0.85 | 0.18 | 2.45 | 0.92 | 0.51 | 1.23 | 0.63 | 0.84 | 0.63 | 0.40 | 1.15 | 1.97 | 2.53 | 2.14 | 2.14 | 0.22 | 0.92 | 2.31 | 0.91 | 0.23 | 1.08 | 0.61 | 0.60 | 0.30 | 1.64 | 1.78 | 0.93 | 0.29 | 0.94 | 1.11 | 1.61 | 0.55 | 0.68 | 0.45 | 0.44 | 0.19 | 0.19 | 0.54 | 2.00 | 1.05 | 0.55 | 0.20 | 2.75 | 2.33 | 0.59 | 1.67 | 0.33 | 1.04 | 0.63 | 0.55 | 0.62 | 0.61 |
| Sulfate | ME917804 | 0.12 | 0.94 | 0.36 | 1.77 | 1.24 | 0.84 | 0.98 | 0.88 | 1.31 | 0.65 | 0.69 | 1.33 | 1.26 | 1.81 | 1.15 | 1.41 | 0.47 | 0.78 | 1.43 | 1.08 | 0.38 | 0.83 | 0.86 | 0.78 | 0.43 | 1.67 | 2.03 | 1.22 | 0.55 | 1.06 | 1.39 | 1.77 | 0.63 | 0.88 | 0.57 | 0.60 | 0.33 | 0.38 | 0.76 | 1.61 | 1.43 | 0.93 | 0.35 | 3.16 | 1.54 | 0.90 | 1.54 | 0.83 | 0.63 | 0.86 | 0.93 | 0.88 | 0.76 |
| Epsilon-(gamma-Glutamyl)-lysine | ME917986 | 0.10 | 1.00 | 0.27 | 1.44 | 1.15 | 0.73 | 1.33 | 0.79 | 1.01 | 0.60 | 0.61 | 1.26 | 2.06 | 1.86 | 2.04 | 1.77 | 0.32 | 1.07 | 2.04 | 1.03 | 0.28 | 0.92 | 0.79 | 0.66 | 0.41 | 1.59 | 1.93 | 1.23 | 0.39 | 1.03 | 1.30 | 1.60 | 0.52 | 0.70 | 0.51 | 0.55 | 0.29 | 0.29 | 0.72 | 1.75 | 1.26 | 0.79 | 0.28 | 2.55 | 1.29 | 0.84 | 1.57 | 0.64 | 1.14 | 0.63 | 0.66 | 0.68 | 0.74 |
| nicotinamide guanine dinucleotide | ME917830 | 0.10 | 1.02 | 0.40 | 0.93 | 1.26 | 0.86 | 1.24 | 0.98 | 1.16 | 0.81 | 0.73 | 1.29 | 1.34 | 1.47 | 1.67 | 1.82 | 0.45 | 1.08 | 1.28 | 1.24 | 0.37 | 0.80 | 0.83 | 0.81 | 0.56 | 1.62 | 1.64 | 1.20 | 0.54 | 1.34 | 1.49 | 1.34 | 0.67 | 0.85 | 0.70 | 0.73 | 0.43 | 0.38 | 0.73 | 1.56 | 1.32 | 0.95 | 0.42 | 1.99 | 1.40 | 0.99 | 1.52 | 0.74 | 1.17 | 0.72 | 0.69 | 0.70 | 0.69 |
| 2S-hydroxy-butanoic acid | ME917753 | 1.34 | 0.67 | 1.29 | 0.84 | 1.07 | 0.95 | 1.41 | 1.47 | 1.00 | 0.87 | 0.71 | 0.78 | 0.41 | 0.86 | 0.99 | 1.28 | 0.94 | 1.42 | 1.12 | 1.02 | 1.59 | 0.44 | 0.88 | 0.88 | 0.83 | 1.28 | 1.00 | 1.19 | 1.11 | 1.19 | 1.22 | 1.10 | 0.50 | 0.88 | 1.02 | 0.80 | 1.17 | 1.08 | 0.71 | 0.91 | 0.85 | 0.70 | 0.99 | 1.15 | 1.30 | 1.15 | 0.71 | 1.27 | NA | NA | NA | NA | 0.65 |
| [FA (11:0)] undecanoic acid | ME917744 | 0.87 | 0.59 | 1.24 | 0.76 | 1.10 | 0.78 | 1.78 | 1.68 | 0.99 | 0.91 | 0.72 | 0.76 | 0.43 | 1.08 | 1.25 | 1.78 | 0.62 | 1.64 | 1.38 | 1.02 | 1.44 | 0.39 | 0.91 | 0.85 | 0.68 | 1.47 | 0.83 | 1.41 | 0.82 | 1.18 | 1.36 | 1.18 | 0.31 | 0.87 | 1.06 | 0.69 | 1.07 | 0.74 | 0.69 | 1.17 | 0.71 | 0.50 | 0.87 | 1.27 | 1.41 | 1.10 | 0.68 | 1.36 | NA | NA | NA | NA | 0.60 |
| alpha-D-Galactosyl-N-acetyllactosamine | ME917887 | NA | 0.66 | NA | NA | 1.50 | 0.82 | 2.72 | 0.97 | 1.77 | 2.03 | 0.71 | 2.13 | 0.98 | 1.08 | 1.04 | 0.99 | 0.13 | 1.54 | 1.75 | 0.64 | 0.78 | 1.80 | 1.19 | 0.53 | 0.46 | 0.95 | 1.02 | 0.50 | 0.27 | 1.07 | 1.11 | 1.51 | 0.50 | 0.84 | 0.56 | 0.54 | 0.81 | 0.28 | 1.22 | 1.69 | 0.56 | 0.25 | 0.30 | 0.74 | 2.27 | 0.42 | 1.21 | 0.31 | 1.06 | NA | NA | NA | 0.78 |
| 6-Phospho-D-gluconate | ME917549 | NA | 0.40 | 0.13 | NA | 1.19 | 0.75 | 1.15 | 0.66 | 0.88 | 1.59 | 0.87 | 1.65 | 0.65 | 1.89 | 1.45 | 1.41 | 0.37 | 1.32 | 1.39 | 0.71 | 0.45 | 0.95 | 1.02 | 0.72 | 1.39 | 1.20 | 1.89 | 0.78 | 0.39 | 1.19 | 1.11 | 1.38 | 0.65 | 0.92 | 0.70 | 0.76 | 0.73 | 0.26 | 1.00 | 1.17 | 0.95 | 0.75 | 0.54 | 0.75 | 1.43 | 0.68 | 1.50 | 0.56 | 2.13 | 1.34 | 1.04 | 1.23 | 0.97 |
| Acetophenazine | ME917598 | NA | 0.41 | 0.19 | NA | 0.73 | 0.72 | 1.58 | 0.44 | 0.67 | 0.98 | 1.00 | 1.78 | 1.14 | 3.08 | 1.33 | 1.56 | 0.78 | 1.22 | 1.76 | 0.76 | 0.24 | 0.63 | 1.06 | 1.05 | 0.84 | 1.29 | 1.58 | 0.59 | 0.48 | 0.92 | 1.22 | 1.18 | 1.08 | 0.87 | 1.19 | 0.82 | 0.25 | 0.19 | 0.75 | 1.69 | 0.41 | 0.56 | 0.15 | 1.12 | 1.80 | 0.79 | 1.62 | 1.33 | 1.39 | 0.97 | 0.98 | 0.92 | 0.87 |
| N2-Succinyl-L-ornithine | ME917708 | 0.52 | 1.17 | 0.67 | NA | 0.92 | 0.85 | 1.58 | 0.81 | 1.19 | 1.76 | 0.81 | 1.53 | 2.03 | 1.94 | 1.69 | 0.73 | 0.41 | 1.20 | 1.60 | 0.51 | 0.48 | 1.37 | 0.76 | 0.59 | 0.82 | 1.40 | 0.77 | 0.62 | 0.44 | 0.82 | 0.94 | 1.27 | 0.86 | 0.84 | 0.77 | 0.77 | 0.72 | 0.75 | 1.01 | 1.83 | 0.57 | 0.64 | 0.65 | 1.02 | 0.96 | 0.55 | 1.51 | 0.73 | 1.54 | 1.00 | 0.92 | 1.13 | 1.05 |
| Pyridoxal phosphate | ME917847 | 0.69 | 0.36 | 0.45 | NA | 0.86 | 1.01 | 1.60 | 0.60 | 0.79 | 1.22 | 0.97 | 1.28 | 0.91 | 1.87 | 2.35 | 1.22 | 0.80 | 1.27 | 1.01 | 0.69 | 0.85 | 1.23 | 1.16 | 0.98 | 0.96 | 1.11 | 0.69 | 0.87 | 1.06 | 0.78 | 0.95 | 1.78 | 1.55 | 1.03 | 1.27 | 1.46 | 0.57 | 0.63 | 0.78 | 0.58 | 0.53 | 0.57 | 0.24 | 0.74 | 0.96 | 0.61 | 1.46 | 1.05 | 1.92 | 0.95 | 0.92 | 0.96 | 0.82 |
| p-Menthane-3,8-diol | ME917692 | 0.32 | 0.75 | 0.52 | 0.91 | 1.22 | 0.97 | 1.63 | 1.31 | 1.11 | 2.04 | 1.41 | 1.84 | 0.98 | 0.56 | 0.68 | 1.16 | 0.35 | 0.85 | 1.16 | 0.69 | 0.77 | 1.53 | 0.75 | 0.91 | 1.00 | 0.82 | 1.43 | 0.96 | 0.68 | 1.27 | 1.49 | 1.37 | 0.92 | 1.26 | 1.13 | 1.22 | 0.66 | 0.57 | 1.11 | 1.71 | 0.77 | 0.59 | 0.58 | 1.35 | 0.74 | 1.18 | 0.93 | 1.10 | 0.24 | 0.85 | 0.80 | 0.97 | 0.86 |
| [PS(18:1)] 1-(9Z-octadecenoyl)-sn-glycero-3-phosphoserine | ME917536 | 0.19 | 0.99 | 0.61 | 1.37 | 1.17 | 1.15 | 1.10 | 0.75 | 0.76 | 1.63 | 1.06 | 1.66 | NA | 1.89 | 0.98 | 1.40 | 0.58 | 1.04 | 0.78 | 0.95 | 0.24 | 0.48 | 1.13 | 0.83 | 1.75 | 1.11 | 1.52 | 1.00 | 0.37 | 0.82 | 0.79 | 1.24 | 0.94 | 1.09 | 1.01 | 0.89 | 0.86 | 0.45 | 1.06 | 1.27 | 1.06 | 0.96 | 0.55 | 0.83 | 0.95 | 0.70 | 1.42 | 0.89 | 0.73 | 1.23 | 1.50 | 1.15 | 1.11 |
| Ala-Ser | ME917811 | 0.86 | 1.04 | 0.98 | NA | 1.11 | 1.10 | 0.42 | 0.86 | 1.41 | 1.43 | 1.18 | 1.35 | 0.46 | NA | NA | 0.78 | 0.97 | 0.78 | NA | 0.75 | 0.73 | 0.90 | 0.95 | 1.01 | 1.25 | NA | 1.23 | 0.65 | 0.58 | 1.03 | 0.74 | 0.81 | 1.19 | 1.53 | 1.58 | 1.06 | 0.82 | 0.85 | 0.73 | 0.53 | 1.18 | 0.76 | 0.77 | 0.76 | NA | 1.21 | 1.58 | 1.47 | NA | 1.28 | 1.07 | 1.08 | 1.17 |
| Glutathione disulfide | ME917574 | 0.04 | 0.14 | 0.10 | 0.28 | 1.44 | 1.45 | 0.84 | 0.80 | 0.87 | 1.74 | 1.74 | 2.03 | 0.44 | 1.51 | 0.66 | 0.69 | 0.90 | 1.05 | 0.68 | 0.79 | 0.43 | 0.68 | 1.55 | 1.42 | 2.24 | 1.00 | 0.80 | 0.52 | 0.33 | 0.93 | 0.77 | 0.80 | 1.51 | 1.56 | 1.40 | 1.38 | 0.77 | 0.40 | 0.68 | 0.70 | 1.00 | 1.15 | 0.54 | 0.75 | 0.98 | 1.18 | 2.13 | 1.45 | 0.81 | 1.31 | 1.25 | 1.27 | 1.12 |
| PA(34:2) | ME917541 | NA | 0.40 | 0.19 | NA | 1.24 | 1.45 | 0.58 | 0.69 | 1.07 | 1.50 | 1.68 | 1.90 | NA | 2.08 | NA | NA | 0.79 | 1.23 | NA | 0.61 | 0.56 | 0.63 | 1.52 | 1.33 | 1.55 | 0.55 | NA | 0.35 | 0.24 | 0.46 | 0.59 | NA | 0.98 | 1.36 | 1.33 | 1.27 | 0.60 | 0.22 | 0.67 | 0.60 | 0.57 | 0.59 | 0.51 | NA | 1.73 | 1.03 | 2.43 | 1.25 | 1.62 | 1.09 | 0.92 | 0.95 | 1.09 |
| 2-Isopropylmaleate | ME917727 | 0.17 | NA | NA | NA | 0.76 | 1.22 | 0.36 | 0.87 | 1.61 | 0.95 | 0.97 | 1.13 | 0.57 | 0.29 | 0.29 | 0.38 | 0.82 | 0.40 | NA | 0.48 | 0.99 | 0.98 | 1.07 | 1.52 | 0.47 | 0.30 | 0.34 | 0.47 | 0.91 | 0.80 | 0.98 | 0.61 | 2.47 | 2.24 | 1.40 | 2.41 | 0.64 | 0.69 | 0.29 | 0.25 | 0.25 | 0.44 | 0.31 | 0.28 | 0.98 | 2.56 | 1.67 | 1.56 | 1.91 | 2.12 | 2.05 | 2.41 | 1.37 |
| L-beta-aspartyl-L-threonine | ME917632 | 0.94 | 0.71 | 0.85 | 0.44 | 0.80 | 1.08 | 0.63 | 0.87 | 0.93 | 1.18 | 1.54 | 0.82 | 0.42 | 0.63 | 0.68 | 0.56 | 0.78 | 1.04 | 0.97 | 1.26 | 1.42 | 1.54 | 1.69 | 1.71 | 0.63 | 0.79 | 0.72 | 0.68 | 1.35 | 1.29 | 1.70 | 1.08 | 1.88 | 2.71 | 2.61 | 1.86 | 0.47 | 0.77 | 0.59 | 0.49 | 0.38 | 0.70 | 0.78 | 0.66 | 0.61 | 1.88 | 1.67 | 1.67 | 0.65 | 1.31 | 1.44 | 1.25 | 1.03 |
| N-Acetylmethionine | ME917667 | 0.68 | 0.66 | 0.87 | 0.31 | 0.61 | 1.27 | 0.72 | 0.66 | 0.70 | 1.28 | 1.78 | 0.60 | 0.42 | 0.84 | 0.95 | 0.41 | 0.60 | 0.98 | 1.11 | 1.20 | 1.30 | 2.01 | 2.14 | 1.45 | 0.52 | 0.96 | 0.87 | 0.54 | 1.08 | 1.49 | 2.31 | 0.87 | 1.53 | 3.30 | 2.63 | 1.54 | 0.35 | 0.66 | 0.66 | 0.34 | 0.29 | 0.79 | 0.86 | 0.51 | 0.41 | 2.11 | 2.03 | 1.21 | 0.42 | 1.44 | 1.95 | 1.26 | 0.85 |
| 4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde | ME917607 | 0.86 | 0.56 | 0.60 | NA | 1.07 | 0.87 | 0.34 | 0.78 | 0.77 | NA | 1.05 | 0.54 | 1.20 | 1.23 | 1.32 | 1.29 | 1.04 | 1.21 | 1.12 | 1.12 | 0.76 | 0.54 | 1.20 | 1.15 | 1.62 | 1.31 | 1.91 | 1.32 | 1.01 | 1.00 | 1.66 | 1.52 | 1.22 | 0.95 | 0.78 | 0.84 | 0.60 | 1.21 | 0.59 | NA | 0.33 | 0.70 | 0.70 | 1.15 | NA | 0.27 | 0.49 | NA | 3.38 | 0.08 | NA | NA | 0.70 |
| Acetyl-CoA | ME917576 | 0.87 | 0.27 | 0.69 | NA | 0.71 | 0.86 | NA | 0.97 | 0.61 | NA | 1.01 | 0.23 | 1.16 | 0.89 | 1.00 | 1.35 | 1.42 | 0.83 | 1.31 | 1.51 | 1.30 | 0.46 | 1.30 | 2.04 | 1.79 | 1.18 | 1.31 | 2.35 | 1.87 | 0.95 | 1.55 | 0.90 | 1.07 | 1.09 | 1.03 | 1.03 | 0.35 | 1.28 | 0.56 | NA | NA | 0.73 | 0.81 | 1.19 | NA | 0.27 | 0.59 | NA | 0.86 | 0.09 | NA | 0.15 | 1.20 |
| Arg-Thr-Gln-Tyr | ME917649 | 0.83 | 0.38 | 0.70 | 0.31 | 0.74 | 0.83 | 0.70 | 0.98 | 0.69 | 0.60 | 1.36 | 0.66 | 0.72 | 0.65 | 1.68 | 1.90 | 1.38 | 1.34 | 1.70 | 1.70 | 2.08 | 2.10 | 1.51 | 1.19 | 1.31 | 1.54 | 1.59 | 1.52 | 0.80 | 1.27 | 0.83 | 1.95 | 1.38 | 0.87 | 1.79 | 0.88 | 0.66 | 1.18 | 0.72 | 0.57 | 0.76 | 1.23 | 1.70 | 1.14 | 0.67 | 1.09 | 0.89 | 1.02 | 0.57 | 0.64 | 0.65 | 0.66 | 0.80 |
| GDP | ME917885 | 0.47 | NA | 0.30 | NA | 0.42 | 0.74 | NA | 0.78 | 1.01 | 0.33 | 0.71 | 0.30 | 0.87 | 1.27 | 1.29 | 1.20 | 1.55 | 2.00 | 1.75 | 1.79 | 2.02 | 1.03 | 1.58 | 1.66 | 0.89 | 1.08 | 1.21 | 1.16 | 1.34 | 1.34 | 1.97 | 1.52 | 1.39 | 1.03 | 1.17 | 0.98 | NA | 0.42 | 0.28 | NA | NA | 0.77 | 0.78 | 0.70 | NA | 0.82 | 0.65 | 0.34 | 1.93 | 0.19 | 0.20 | 0.09 | 0.68 |
| Dihydronaringenin-O-sulphate | ME917533 | 0.59 | 0.39 | 0.42 | NA | 0.50 | 0.71 | 0.50 | 0.48 | 1.00 | 0.83 | 0.82 | 0.52 | 0.81 | 0.90 | 0.97 | 1.09 | 2.02 | 1.75 | 1.73 | 1.60 | 1.91 | 1.31 | 1.42 | 1.50 | 1.25 | 0.98 | 0.60 | 1.00 | 1.53 | 1.40 | 1.76 | 1.43 | 1.59 | 1.08 | 1.37 | 1.03 | NA | 0.90 | 0.24 | 0.22 | NA | 0.29 | 0.67 | 0.67 | 0.59 | 1.06 | 0.76 | 0.37 | 1.77 | NA | NA | NA | 0.65 |
| Leucyl-Hydroxyproline | ME917884 | 0.59 | 0.42 | 0.50 | 0.14 | 0.62 | 1.08 | 0.25 | 0.90 | 0.79 | 0.57 | 0.70 | 0.40 | 0.90 | 0.63 | 1.13 | 1.11 | 2.10 | 1.91 | 1.78 | 1.44 | 2.10 | 1.18 | 1.50 | 1.42 | 1.36 | 1.10 | 1.00 | 1.15 | 1.60 | 1.58 | 1.75 | 1.20 | 1.52 | 1.03 | 0.78 | 1.02 | 0.48 | 0.78 | 0.35 | NA | 0.61 | 0.62 | 0.76 | 1.03 | 0.61 | 1.21 | 0.69 | 0.67 | 1.04 | NA | NA | NA | 0.84 |
| Glu-Ile-Thr | ME917688 | 0.53 | 0.41 | 0.47 | 0.38 | 0.57 | 1.16 | 0.67 | 0.46 | 0.41 | 0.46 | 0.81 | 0.48 | 1.34 | 1.29 | 1.78 | 1.84 | 2.28 | 2.52 | 2.32 | 2.14 | 1.72 | 1.04 | 1.53 | 1.57 | 1.61 | 1.01 | 1.81 | 1.59 | 1.79 | 1.45 | 2.06 | 2.25 | 1.04 | 0.49 | 1.07 | 0.99 | 0.49 | 0.86 | 0.37 | 0.31 | 0.33 | 0.42 | 0.93 | 1.07 | 0.46 | 0.71 | 0.48 | 0.49 | 0.45 | 0.42 | 0.20 | 0.34 | 0.86 |
| phe-FMDP | ME917653 | 0.42 | NA | 0.26 | NA | 0.69 | 0.80 | 0.59 | 0.53 | 0.77 | 0.38 | 0.67 | 0.53 | 0.52 | 0.90 | 1.06 | 1.76 | 2.06 | 2.14 | 2.12 | 1.98 | 2.29 | 0.89 | 1.71 | 1.73 | 1.05 | 0.87 | 1.34 | 1.40 | 1.24 | 1.57 | 1.09 | 1.25 | 0.80 | 1.02 | 1.68 | 0.94 | NA | 0.35 | 0.52 | NA | NA | 0.43 | 0.32 | 0.49 | 0.47 | 1.24 | 0.61 | 0.54 | 0.28 | NA | NA | NA | 0.71 |
| UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6- diaminopimelate | ME917876 | 0.61 | 0.33 | 0.30 | NA | 0.77 | 0.71 | 0.69 | 0.46 | 0.91 | 0.61 | 0.68 | 0.35 | 1.09 | 1.31 | 1.15 | 1.45 | 1.95 | 2.64 | 2.06 | 1.65 | 2.24 | 1.24 | 1.60 | 1.10 | 1.31 | 1.00 | 1.08 | 0.99 | 1.70 | 1.52 | 1.69 | 1.61 | 1.17 | 0.84 | 1.09 | 0.72 | 0.45 | 0.57 | 0.34 | NA | 0.37 | 0.42 | 0.68 | 0.47 | 0.68 | 0.87 | 0.48 | 0.42 | NA | NA | NA | NA | 0.63 |
| Phe-Gly | ME917832 | 0.63 | 0.19 | 0.31 | NA | 0.75 | 0.91 | 0.85 | 0.80 | 1.02 | 0.71 | 0.75 | 0.45 | 0.84 | 1.18 | 1.41 | 1.47 | 1.72 | 1.74 | 2.08 | 1.84 | 1.96 | 1.73 | 1.90 | 1.90 | 0.98 | 0.96 | 1.24 | 1.03 | 1.36 | 1.71 | 2.30 | 1.73 | 1.40 | 0.99 | 1.62 | 1.40 | 0.23 | 0.60 | 0.41 | 0.20 | 0.21 | 0.44 | 0.69 | 0.67 | 0.73 | 0.80 | 0.74 | 0.58 | 0.19 | 0.24 | 0.23 | 0.19 | 0.99 |
| Succinyl-CoA | ME917563 | 0.15 | NA | 0.16 | NA | 0.55 | 0.58 | 0.66 | 0.67 | 0.73 | 0.72 | 0.74 | 0.42 | 1.60 | 1.32 | 1.36 | 1.35 | 1.74 | 1.65 | 2.69 | 1.54 | 1.57 | 1.55 | 1.57 | 1.08 | 1.05 | 0.82 | 1.34 | 1.03 | 1.05 | 0.98 | 1.81 | 1.86 | 0.99 | 0.96 | 1.18 | 1.12 | NA | 0.69 | 0.45 | NA | 0.49 | 0.38 | 0.72 | 0.63 | 0.61 | 0.64 | 0.72 | 0.38 | NA | NA | NA | NA | 0.69 |
| IAA-94 | ME917843 | 0.18 | 0.41 | 0.20 | NA | 1.27 | 1.17 | 0.78 | 1.04 | 1.22 | 0.92 | 0.74 | 1.04 | 1.08 | 1.36 | 1.04 | 1.84 | 1.01 | 1.88 | 2.83 | 1.56 | 0.55 | 1.43 | 0.96 | 0.85 | 0.29 | 1.37 | 0.78 | 0.74 | 0.66 | 1.63 | 1.61 | 1.74 | 0.87 | 1.30 | 1.16 | 0.91 | 0.28 | 0.59 | 0.84 | 1.51 | 0.57 | 0.62 | 0.21 | NA | 0.74 | 0.92 | 1.22 | 1.02 | 1.26 | 0.95 | 0.92 | 1.00 | 0.90 |
| Polypropylene glycol (m w 1,200-3,000) | ME917683 | 0.40 | NA | 0.29 | NA | 0.68 | 0.63 | NA | 0.27 | 0.86 | 0.74 | 0.71 | 0.93 | 0.88 | 1.45 | 1.36 | 1.40 | 1.56 | 1.50 | 2.41 | 1.32 | 0.93 | 1.79 | 1.27 | 1.22 | 0.71 | 1.09 | 0.87 | 0.64 | 0.79 | 1.49 | 0.99 | 1.35 | 1.21 | 1.37 | 1.23 | 1.00 | 0.27 | 0.48 | 0.56 | 0.52 | NA | 0.26 | 0.22 | NA | 1.96 | 1.25 | 1.43 | 0.72 | 1.57 | 0.77 | 0.88 | 0.87 | 0.92 |
| Ile-Gly-Met | ME917844 | 0.31 | 0.75 | NA | NA | 1.32 | 1.09 | 1.04 | 0.78 | 0.80 | 0.70 | 0.76 | 0.59 | 1.18 | 0.87 | 1.17 | 1.15 | 1.76 | 1.93 | 1.19 | 1.51 | 1.20 | 1.84 | 1.16 | 0.75 | 1.48 | 1.06 | 1.53 | 1.19 | 1.16 | 1.18 | 0.94 | 1.47 | 1.05 | 0.94 | 1.05 | 0.90 | 0.84 | NA | 0.69 | 0.53 | NA | 0.57 | 0.60 | 0.54 | NA | 1.17 | 0.85 | 0.28 | NA | 0.97 | 1.37 | 0.78 | 0.86 |
| N-Acetyl-D-glucosamine 6-phosphate | ME917684 | 0.50 | 0.36 | 0.28 | 0.29 | 1.09 | 1.46 | 0.73 | 1.12 | 1.63 | 1.09 | 1.21 | 1.14 | 0.90 | 0.66 | 0.71 | 1.03 | 2.19 | 1.94 | 1.09 | 1.35 | 1.86 | 1.74 | 1.05 | 1.01 | 1.26 | 0.97 | 1.41 | 1.24 | 1.14 | 1.71 | 1.26 | 1.29 | 1.20 | 1.18 | 0.88 | 1.03 | 0.78 | 0.54 | 0.48 | 0.59 | 0.30 | 0.40 | 0.41 | 0.60 | 0.69 | 1.57 | 1.98 | 0.54 | 2.13 | 1.32 | 1.09 | 1.19 | 1.13 |
| D-Glucose 6-phosphate | ME917635 | 0.23 | 0.20 | 0.58 | 1.61 | 0.68 | 0.72 | 0.92 | 1.22 | 0.18 | 0.54 | 0.63 | 1.25 | 0.98 | 0.78 | 1.94 | 2.46 | 1.06 | 1.42 | 1.97 | 1.79 | 0.98 | 1.10 | 1.52 | 1.74 | 0.81 | 0.87 | 2.17 | 1.96 | 0.66 | 0.97 | 1.42 | 1.45 | 0.62 | 0.58 | 0.95 | 1.51 | 0.23 | 0.57 | 0.96 | 1.33 | 0.24 | 0.42 | 0.82 | 1.22 | 0.28 | 0.64 | 0.85 | 1.06 | 1.88 | 1.12 | 1.21 | 1.76 | 1.92 |
| 1-O-Methyl-myo-inositol | ME917824 | 1.11 | 1.61 | 0.83 | 1.70 | 1.14 | 1.36 | 0.88 | 0.83 | 0.51 | 1.27 | 0.75 | 1.55 | 1.25 | 1.27 | 0.93 | 0.80 | 0.65 | 0.65 | 1.31 | 0.88 | 0.44 | 1.71 | 0.85 | 0.61 | 0.92 | 1.65 | NA | 1.00 | 1.05 | 1.15 | 1.68 | 0.93 | 1.17 | 1.22 | 0.79 | 0.89 | 0.81 | 0.71 | 0.57 | 0.86 | 0.66 | 0.76 | 0.62 | NA | 2.04 | 0.95 | 0.69 | 0.90 | 2.12 | 1.16 | 1.09 | 1.16 | 1.24 |
| Tetradecanoic acid | ME917661 | 2.79 | 1.32 | 1.72 | 0.94 | 0.37 | 1.02 | 0.32 | 0.81 | 0.43 | 0.34 | 1.02 | 0.57 | 0.90 | 0.41 | 0.52 | 0.74 | 1.63 | 0.64 | 0.73 | 0.96 | 1.20 | 0.54 | 0.99 | 2.65 | 0.97 | 0.90 | 0.66 | 2.06 | 1.28 | 0.40 | 0.54 | 0.51 | 1.22 | 0.43 | 0.53 | 0.91 | 0.57 | 1.84 | 0.77 | 0.43 | 0.77 | 1.51 | 1.87 | 2.96 | 0.28 | 0.31 | 0.39 | 0.40 | 0.80 | 1.52 | 1.65 | 1.59 | 1.37 |
| Tryptophyl-Proline | ME917981 | 2.86 | 1.12 | 1.63 | 0.66 | 0.44 | 0.94 | 0.36 | 0.71 | 0.59 | 0.37 | 0.86 | 0.43 | 0.89 | 0.47 | 0.51 | 0.66 | 1.57 | 0.73 | 0.89 | 0.89 | 1.08 | 0.75 | 0.96 | 1.59 | 1.20 | 1.03 | 0.69 | 1.44 | 1.30 | 0.64 | 0.84 | 0.56 | 1.04 | 0.61 | 0.75 | 1.12 | 0.45 | 1.56 | 0.57 | 0.29 | 0.77 | 1.32 | 1.68 | 3.11 | 0.36 | 0.45 | 0.41 | 0.49 | 2.73 | 1.36 | 1.29 | 1.55 | 1.42 |
| PG(33:1) | ME917586 | 2.83 | 1.14 | 1.26 | 0.71 | 0.75 | 0.87 | NA | 0.75 | 0.58 | 0.40 | 0.98 | 0.65 | 0.56 | 0.41 | 0.54 | 0.84 | 1.26 | 0.26 | 0.25 | 0.84 | 0.89 | 0.41 | 0.98 | 1.79 | 1.78 | 1.14 | 1.01 | 1.65 | 1.32 | 0.77 | 0.66 | 0.67 | 1.14 | 0.73 | 0.87 | 1.09 | 0.49 | 1.50 | 0.64 | 0.34 | 0.75 | 1.26 | 1.35 | 2.56 | NA | 0.43 | 0.51 | 0.34 | 2.17 | 1.55 | 1.65 | 1.60 | 1.07 |
| 2-Amino-5-phosphopentanoic acid | ME918021 | 3.02 | 1.65 | 1.50 | 0.69 | 0.61 | 0.80 | 0.25 | 0.86 | 0.70 | 0.44 | 0.91 | 0.64 | 0.70 | 0.30 | 0.53 | 0.79 | 1.29 | 0.67 | 0.39 | 0.79 | 1.01 | 0.42 | 0.76 | 1.59 | 1.27 | 0.98 | 1.03 | 1.68 | 0.94 | 0.65 | 0.69 | 0.70 | 1.11 | 0.62 | 0.74 | 0.96 | 0.66 | 1.64 | 0.80 | 0.45 | 0.81 | 1.49 | 1.74 | 2.24 | NA | 0.24 | 0.56 | 0.25 | 2.61 | 1.50 | 1.70 | 1.70 | 0.97 |
| L-Methionine S-oxide | ME918020 | 2.93 | 1.35 | 1.63 | 0.90 | 0.55 | 0.88 | 0.29 | 0.87 | 0.50 | 0.32 | 0.97 | 0.55 | 0.77 | 0.41 | 0.48 | 0.79 | 1.34 | 0.51 | 0.74 | 0.87 | 1.12 | 0.51 | 0.88 | 1.61 | 1.14 | 1.10 | 0.82 | 1.60 | 1.20 | 0.52 | 0.65 | 0.45 | 1.23 | 0.65 | 0.50 | 0.96 | 0.55 | 1.61 | 0.73 | 0.35 | 1.02 | 1.70 | 1.91 | 2.63 | 0.25 | 0.34 | 0.48 | 0.30 | 2.31 | 1.63 | 1.58 | 1.64 | 1.36 |
| PE(32:1) | ME918009 | 2.11 | 1.29 | 1.20 | 1.02 | 0.42 | 0.90 | 0.48 | 0.84 | 0.94 | 0.56 | 0.97 | 0.73 | 1.45 | 0.85 | 1.25 | 1.54 | 1.00 | 0.61 | 0.99 | 0.82 | 0.76 | 0.66 | 0.84 | 1.21 | 1.52 | 1.43 | 1.95 | 1.98 | 0.94 | 0.50 | 0.79 | 1.01 | 1.13 | 0.85 | 0.63 | 1.06 | 0.60 | 1.44 | 0.98 | 0.86 | 0.82 | 1.09 | 1.23 | 1.71 | 0.51 | 0.27 | 0.63 | 0.36 | 2.14 | 1.02 | 1.10 | 0.99 | 1.01 |
| butyrylcholine | ME917961 | 2.47 | 1.43 | 1.38 | 0.88 | 0.53 | 0.77 | 0.64 | 0.64 | 0.72 | 0.51 | 0.83 | 0.49 | 1.41 | 1.16 | 1.08 | 0.75 | 1.08 | 1.31 | 1.46 | 0.87 | 0.93 | 0.98 | 1.23 | 1.07 | 0.99 | 0.94 | 1.61 | 1.33 | 0.99 | 0.55 | 0.83 | 0.86 | 1.03 | 0.49 | 0.68 | 0.97 | 0.48 | 1.33 | 0.65 | 0.61 | 0.84 | 1.10 | 1.46 | 2.03 | 0.46 | 0.45 | 0.43 | 0.44 | 2.55 | 1.16 | 1.10 | 1.16 | 0.85 |
| Inosine | ME917931 | 2.85 | 1.74 | 1.62 | 1.38 | 0.85 | 0.81 | 0.40 | 0.70 | 0.76 | 0.48 | 0.85 | 0.56 | 1.36 | 1.08 | 1.04 | 1.21 | 1.00 | 0.69 | 1.39 | 0.99 | 0.80 | 0.71 | 1.13 | 1.11 | 1.33 | 1.09 | 1.41 | 1.58 | 0.92 | 0.84 | 0.86 | 0.96 | 1.15 | 0.78 | 0.72 | 0.85 | 0.51 | 1.19 | 0.80 | 0.70 | 0.60 | 0.93 | 1.04 | 1.66 | 0.68 | 0.40 | 0.52 | 0.30 | 2.88 | 1.00 | 0.97 | 0.96 | 0.84 |
| 4-[N-γ-L-glutamyl-)-p-(β-aminoethyl)phenoxy-methyl]-2-(aminomethyl)furan | ME917705 | 1.67 | 0.90 | 0.96 | 0.51 | 0.53 | 0.83 | 0.44 | 0.67 | 0.67 | 0.50 | 0.97 | 0.55 | 1.23 | 0.79 | 1.61 | 1.49 | 1.62 | 0.99 | 1.18 | 1.66 | 1.14 | 0.87 | 1.48 | 1.40 | 1.96 | 1.32 | 1.90 | 1.98 | 0.99 | 0.95 | 1.23 | 1.02 | 1.03 | 0.71 | 0.67 | 0.97 | 0.57 | 1.05 | 0.81 | 0.48 | 0.77 | 0.90 | 1.07 | 1.18 | 0.31 | 0.54 | 0.69 | 0.45 | 1.06 | 0.92 | 0.94 | 0.96 | 0.94 |
| D-Glucono-1,5-lactone 6-phosphate | ME917572 | 1.75 | 0.72 | 0.80 | 0.42 | 0.59 | 1.09 | 0.26 | 0.71 | 0.85 | 0.44 | 0.88 | 0.45 | 1.04 | 0.61 | 0.74 | 1.09 | 1.58 | 0.69 | 0.61 | 1.28 | 1.12 | 0.82 | 1.36 | 1.33 | 1.42 | 0.98 | 1.09 | 1.48 | 1.07 | 0.66 | 0.99 | 0.75 | 1.57 | 0.68 | 0.95 | 1.31 | 0.41 | 1.15 | 0.84 | 0.37 | 0.59 | 1.09 | 1.04 | 1.60 | NA | 0.45 | 0.45 | 0.60 | 2.46 | 1.67 | 1.93 | 1.93 | 1.22 |
| FA oxo(12:1) | ME917736 | 1.91 | 1.01 | 1.06 | 0.55 | 0.66 | 0.86 | 0.30 | 0.79 | 0.64 | 0.38 | 1.01 | 0.53 | 0.66 | 0.61 | 1.01 | 0.97 | 1.33 | 0.82 | 1.18 | 1.16 | 1.08 | 0.76 | 1.08 | 1.68 | 1.25 | 1.18 | 1.30 | 1.50 | 1.07 | 0.81 | 1.09 | 1.01 | 1.42 | 1.09 | 0.94 | 1.22 | 0.51 | 1.10 | 0.75 | 0.41 | 0.79 | 1.01 | 1.08 | 1.45 | 0.42 | 0.64 | 0.80 | 0.39 | 2.87 | 1.51 | 1.66 | 1.67 | 1.01 |
| Betaine | ME917997 | 1.61 | 0.71 | 1.01 | 0.42 | 0.59 | 0.94 | 0.29 | 0.88 | 0.71 | 0.38 | 0.92 | 0.52 | 0.85 | 0.73 | 0.75 | 1.10 | 1.60 | 0.88 | 1.21 | 1.54 | 1.16 | 0.76 | 1.23 | 2.02 | 1.29 | 0.96 | 0.97 | 1.55 | 1.44 | 0.85 | 1.19 | 0.84 | 1.51 | 0.93 | 1.07 | 1.18 | 0.54 | 1.31 | 0.58 | 0.44 | 0.56 | 0.95 | 0.95 | 2.13 | 0.43 | 0.51 | 0.56 | 0.65 | 1.97 | 1.48 | 1.39 | 1.46 | 1.45 |
| UDP-N-acetyl-D-galactosamine | ME917858 | 2.57 | 0.97 | 1.06 | 0.60 | 0.49 | 0.80 | 0.42 | 0.94 | 0.55 | 0.25 | 0.99 | 0.50 | 0.73 | 0.59 | 0.75 | 1.03 | 1.38 | 0.83 | 0.99 | 1.37 | 1.12 | 0.79 | 1.13 | 1.89 | 1.03 | 0.83 | 0.87 | 1.32 | 1.22 | 0.86 | 1.07 | 0.98 | 1.44 | 0.75 | 1.04 | 0.99 | 0.60 | 1.38 | 0.70 | 0.33 | 0.92 | 1.41 | 1.55 | 2.07 | 0.21 | 0.49 | 0.57 | 0.40 | 2.54 | 1.13 | 1.22 | 1.36 | 0.99 |
| Leu-Tyr | ME917644 | 1.98 | 1.23 | 1.36 | 0.84 | 0.58 | 0.87 | 0.26 | 0.85 | 0.80 | 0.51 | 1.00 | 0.60 | 0.70 | 0.54 | 0.73 | 1.09 | 1.45 | 0.82 | 0.76 | 1.13 | 1.23 | 0.70 | 1.06 | 1.86 | 1.25 | 1.11 | 1.08 | 1.50 | 1.17 | 0.73 | 0.83 | 0.89 | 1.26 | 0.88 | 0.87 | 1.28 | 0.54 | 1.24 | 0.71 | 0.42 | 0.90 | 1.37 | 1.56 | 1.58 | 0.30 | 0.71 | 0.59 | 0.42 | 1.81 | 1.33 | 1.28 | 1.44 | 1.01 |
| L-Methionine | ME917974 | 2.02 | 1.18 | 1.18 | 0.53 | 0.63 | 0.97 | 0.24 | 0.76 | 0.91 | 0.40 | 1.08 | 0.49 | 0.82 | 0.62 | 0.59 | 1.31 | 1.53 | 0.65 | 0.85 | 1.00 | 1.14 | 0.68 | 1.17 | 1.83 | 1.17 | 1.12 | 1.03 | 1.59 | 1.16 | 0.70 | 0.96 | 0.81 | 1.36 | 1.02 | 0.80 | 1.38 | 0.46 | 1.37 | 0.67 | 0.39 | 0.89 | 1.36 | 1.40 | 2.14 | 0.37 | 0.54 | 0.59 | 0.40 | 2.58 | 1.20 | 1.27 | 1.42 | 1.25 |
| Cysteinyl-Proline | ME917823 | 2.35 | 0.78 | 0.46 | 0.84 | 0.53 | 0.67 | NA | 0.77 | 0.48 | 0.28 | 0.70 | 0.67 | 1.53 | 1.07 | 0.84 | 1.21 | 1.16 | 1.03 | 0.97 | 1.32 | 1.11 | 1.13 | 1.28 | 1.83 | 1.11 | 0.91 | 1.02 | 1.35 | 1.44 | 1.16 | 1.16 | 1.07 | 1.06 | 0.81 | 1.02 | 1.24 | 0.36 | 0.86 | 0.58 | 0.24 | 0.56 | 0.81 | 1.15 | 1.64 | NA | 0.43 | 0.72 | 0.33 | 1.62 | 1.28 | 1.66 | 1.46 | 0.93 |
| FA oxo(7:0) | ME917669 | 1.46 | 0.87 | 0.98 | 0.49 | 0.58 | 0.91 | NA | 0.64 | 0.64 | 0.32 | 0.65 | 0.52 | 0.93 | 0.62 | 1.14 | 1.12 | 1.83 | 1.00 | 1.29 | 1.64 | 0.95 | 0.62 | 1.25 | 1.35 | 1.48 | 0.97 | 1.52 | 1.93 | 1.26 | 0.88 | 0.92 | 0.88 | 1.50 | 0.73 | 0.68 | 0.97 | NA | 1.09 | 0.59 | 0.39 | 0.67 | 0.97 | 0.89 | 1.25 | NA | 0.30 | 0.60 | 0.51 | 1.07 | 1.68 | 1.73 | 1.65 | 1.04 |
| (R)-2-Hydroxyglutarate | ME917693 | 1.46 | 0.73 | 0.88 | 0.46 | 0.72 | 0.96 | 0.54 | 0.92 | 0.90 | 0.59 | 1.00 | 0.65 | 0.88 | 0.86 | 1.07 | 1.30 | 1.03 | 1.05 | 1.00 | 1.10 | 0.82 | 0.70 | 1.02 | 1.39 | 1.43 | 1.22 | 1.71 | 1.71 | 1.00 | 0.68 | 0.95 | 1.12 | 1.33 | 1.05 | 0.84 | 1.22 | 0.57 | 1.16 | 0.78 | 0.55 | 0.63 | 0.72 | 0.87 | 1.08 | 0.27 | 0.51 | 0.69 | 0.49 | 1.49 | 1.91 | 1.93 | 1.99 | 1.07 |
| L-Valine | ME917750 | 1.62 | 0.95 | 1.01 | 0.47 | 0.72 | 0.92 | 0.44 | 0.77 | 0.85 | 0.60 | 1.02 | 0.62 | 1.08 | 0.98 | 1.25 | 1.31 | 1.14 | 0.87 | 0.97 | 1.38 | 0.84 | 0.75 | 1.29 | 1.24 | 1.39 | 1.11 | 1.62 | 1.51 | 0.98 | 0.66 | 0.98 | 0.78 | 1.09 | 1.02 | 0.91 | 1.03 | 0.59 | 1.05 | 0.79 | 0.52 | 0.65 | 0.88 | 0.95 | 1.42 | 0.42 | 0.52 | 0.74 | 0.49 | 1.39 | 1.90 | 1.70 | 1.81 | 1.02 |
| 4-Amino-2-methyl-5-phosphomethylpyrimidine | ME917842 | 1.61 | 0.98 | 0.86 | 0.75 | 0.68 | 0.75 | 0.58 | 0.70 | 0.71 | 0.52 | 0.85 | 0.63 | 1.11 | 0.99 | 1.16 | 1.42 | 1.30 | 0.85 | 1.15 | 1.36 | 1.00 | 0.65 | 1.22 | 1.48 | 1.54 | 1.23 | 1.55 | 1.59 | 1.07 | 0.58 | 1.32 | 0.81 | 1.10 | 0.78 | 0.71 | 1.00 | 0.46 | 1.08 | 0.74 | 0.49 | 0.69 | 0.97 | 0.94 | 1.32 | 0.29 | 0.52 | 0.71 | 0.29 | 1.33 | 1.85 | 1.86 | 1.85 | 1.03 |
| FA methyl(16:1) | ME917751 | 1.60 | 0.85 | 0.87 | 0.55 | 0.69 | 0.85 | 0.39 | 0.74 | 0.71 | 0.47 | 0.99 | 0.52 | 1.03 | 0.72 | 1.05 | 1.24 | 1.39 | 1.15 | 1.07 | 1.21 | 1.01 | 0.70 | 1.27 | 1.41 | 1.46 | 1.24 | 1.38 | 1.53 | 1.00 | 0.78 | 1.05 | 0.99 | 1.16 | 0.86 | 0.72 | 1.12 | 0.52 | 1.09 | 0.70 | 0.32 | 0.75 | 0.91 | 1.09 | 1.43 | 0.27 | 0.59 | 0.71 | 0.47 | 1.48 | 2.01 | 1.90 | 1.93 | 1.05 |
| N-arachidonoyl alanine | ME917854 | 1.44 | 1.13 | 0.88 | 0.47 | 0.53 | 0.94 | 0.36 | 0.78 | 0.81 | 0.53 | 0.93 | 0.58 | 1.18 | 0.78 | 0.88 | 1.04 | 1.46 | 1.11 | 1.07 | 1.31 | 1.44 | 1.07 | 1.35 | 1.52 | 1.43 | 0.91 | 1.42 | 1.45 | 1.13 | 0.98 | 1.19 | 0.92 | 1.66 | 0.98 | 0.87 | 1.27 | 0.52 | 1.13 | 0.69 | 0.47 | 0.72 | 0.81 | 0.90 | 1.43 | 0.46 | 0.55 | 0.60 | 0.51 | 0.89 | 1.54 | 1.53 | 1.31 | 1.17 |
| P-DPD | ME917752 | 1.85 | 0.92 | 0.82 | 0.60 | 0.62 | 1.08 | 0.42 | 0.79 | 0.86 | 0.44 | 0.79 | 0.54 | 1.03 | 0.73 | 0.73 | 1.32 | 1.49 | 1.06 | 0.96 | 1.07 | 1.21 | 0.92 | 1.52 | 1.70 | 1.33 | 0.89 | 1.03 | 1.36 | 1.18 | 0.78 | 0.93 | 0.94 | 1.21 | 0.76 | 0.72 | 1.23 | 0.34 | 1.20 | 0.66 | 0.40 | 0.68 | 0.85 | 1.13 | 1.58 | NA | 0.55 | 0.54 | 0.35 | 1.01 | 2.04 | 1.86 | 1.85 | 1.11 |
| 5-Hydroxypentanoate | ME917664 | 1.44 | 1.39 | 1.23 | 0.65 | 0.92 | 1.44 | 1.12 | 1.24 | 1.39 | 0.95 | 0.77 | 0.62 | 1.33 | 1.20 | 1.22 | 0.73 | 1.22 | 1.39 | 2.19 | 1.45 | 1.29 | 1.43 | 1.05 | 0.95 | 0.95 | 0.74 | 0.81 | 0.88 | 1.05 | 1.43 | 1.38 | 1.23 | 0.89 | 1.33 | 1.17 | 0.71 | 0.68 | 0.66 | 0.65 | 0.84 | 0.58 | 0.61 | 0.57 | 1.60 | 0.87 | 1.12 | 1.20 | 0.48 | 2.57 | 1.17 | 0.97 | 0.99 | 1.10 |
| Phe-Thr | ME917696 | 2.56 | 0.67 | 1.87 | 0.67 | 0.86 | 1.45 | 0.66 | 1.78 | 1.28 | 0.93 | 0.91 | 0.54 | 0.71 | 0.59 | 0.85 | 0.47 | 1.94 | 1.04 | 1.25 | 1.94 | 1.60 | 0.94 | 1.04 | 0.71 | 0.96 | 0.74 | 0.61 | 0.95 | 1.64 | 1.41 | 1.42 | 0.98 | 1.24 | 1.51 | 1.35 | 0.88 | 0.65 | 0.70 | 0.57 | 0.48 | 0.53 | 0.54 | 0.75 | 1.45 | 0.78 | 1.16 | 1.15 | 0.85 | 1.98 | 1.23 | 1.12 | 1.23 | 0.77 |
| FA methyl(15:0) tridecanedioic acid | ME917784 | 1.60 | 0.64 | 1.05 | 1.38 | 0.72 | 1.04 | 0.81 | 1.11 | 1.07 | 0.76 | 0.67 | 0.99 | 0.63 | 0.64 | 0.63 | 0.47 | 0.94 | 0.90 | 1.13 | 1.18 | 1.61 | 1.86 | 1.59 | 1.32 | 1.18 | 0.99 | 1.14 | 1.17 | 0.91 | 1.02 | 1.50 | 0.80 | 1.74 | 1.17 | 1.05 | 0.77 | 0.82 | 0.98 | 0.83 | 0.66 | 0.75 | 0.88 | 0.83 | 1.46 | 2.47 | 0.93 | 0.82 | 0.98 | 0.55 | 1.91 | 1.55 | 1.35 | 1.51 |
| Cyclo(deltaAla-L-Val) | ME918029 | 1.62 | 1.06 | 1.01 | 0.65 | 0.72 | 1.16 | 0.36 | 1.08 | 1.17 | 0.95 | 1.30 | 1.01 | 0.59 | 0.45 | 0.34 | 0.72 | 1.00 | 0.60 | 0.74 | 0.80 | 0.91 | 0.96 | 1.37 | 1.81 | 0.91 | 0.90 | 0.57 | 0.94 | 1.04 | 0.76 | 1.08 | 0.97 | 2.42 | 1.90 | 1.61 | 2.02 | 0.58 | 1.33 | 0.82 | 0.52 | 0.67 | 0.93 | 0.95 | 1.77 | 0.64 | 0.90 | 1.32 | 0.69 | 2.14 | 2.14 | 1.90 | 1.94 | 1.21 |
| PE(32:2) | ME917814 | 1.62 | 1.07 | 1.02 | 0.65 | 0.72 | 1.16 | 0.36 | 1.08 | 1.30 | 0.95 | 1.40 | 1.02 | 0.59 | 0.43 | 0.32 | 0.72 | 1.00 | 0.59 | 0.83 | 0.85 | 0.91 | 1.03 | 1.41 | 1.73 | 0.97 | 0.95 | 0.66 | 0.96 | 1.12 | 0.76 | 1.07 | 1.02 | 2.43 | 1.90 | 1.61 | 2.02 | 0.58 | 1.33 | 0.82 | 0.52 | 0.68 | 0.93 | 0.95 | 1.50 | 0.64 | 0.90 | 1.32 | 0.70 | 1.40 | 2.15 | 2.14 | 2.08 | 1.11 |
| 3-Propylmalate | ME917689 | 1.74 | 0.90 | 1.29 | 0.60 | 0.68 | 0.97 | 0.59 | 0.96 | 0.88 | 0.76 | 1.26 | 0.72 | 0.67 | 0.74 | 0.66 | 0.68 | 1.74 | 0.63 | 0.69 | 1.10 | 0.98 | 0.86 | 1.03 | 1.33 | 1.15 | 0.58 | 0.68 | 0.81 | 1.44 | 0.74 | 0.94 | 0.81 | 1.67 | 0.95 | 1.06 | 1.55 | 0.96 | 1.45 | 0.80 | 0.64 | 1.03 | 1.30 | 1.18 | 0.86 | 0.57 | 1.10 | 0.85 | 1.37 | 1.73 | 1.57 | 1.82 | 2.38 | 1.06 |
| CDP | ME917893 | 1.18 | 0.80 | 0.81 | 0.37 | 0.78 | 1.09 | 0.38 | 0.69 | 0.90 | 0.72 | 1.22 | 0.67 | 1.03 | 0.70 | 0.99 | 0.81 | 1.74 | 0.96 | 0.68 | 1.40 | 1.44 | 1.17 | 1.31 | 1.49 | 1.54 | 0.97 | 0.86 | 1.12 | 1.80 | 1.11 | 1.10 | 0.86 | 1.86 | 1.23 | 1.28 | 1.48 | 0.74 | 1.16 | 0.57 | 0.37 | 0.99 | 1.22 | 1.20 | 0.80 | 0.34 | 1.18 | 0.96 | 0.85 | 1.40 | 2.06 | 2.08 | 2.10 | 1.25 |
| [FA trihydroxy(4:0)] 2,3,4-trihydroxy-butanoic acid | ME917645 | 0.76 | 0.62 | 0.75 | 0.56 | 0.64 | 1.33 | 1.74 | 0.75 | 1.00 | 0.76 | 0.71 | 0.68 | 1.40 | 1.64 | 1.07 | 0.69 | 1.01 | 1.58 | 0.90 | 0.89 | 1.41 | 0.98 | 1.50 | 1.16 | 1.10 | 0.69 | 1.00 | 1.06 | 1.58 | 1.38 | 1.40 | 0.70 | 0.82 | 0.90 | 0.70 | 1.92 | 0.71 | 0.78 | 0.67 | 0.86 | 0.64 | 0.72 | 0.72 | 0.64 | 0.68 | 0.94 | 1.03 | 0.60 | 1.14 | 1.36 | 1.39 | 1.43 | 1.44 |
| Adenylylselenate | ME917637 | 0.78 | 0.57 | 0.92 | 0.49 | 0.55 | 1.37 | 1.70 | 0.92 | 1.24 | 0.64 | 0.66 | 0.58 | 1.26 | 1.69 | 0.82 | 0.56 | 1.00 | 1.50 | 0.80 | 0.89 | 1.58 | 0.74 | 1.72 | 1.25 | 1.19 | 0.84 | 1.10 | 1.11 | 1.70 | 1.37 | 1.29 | 0.57 | 0.83 | 0.87 | 0.61 | 1.64 | 0.72 | 0.91 | 0.59 | 0.89 | 0.75 | 0.51 | 0.58 | 0.57 | 0.54 | 1.03 | 1.17 | 0.59 | 1.10 | 1.81 | 1.70 | 1.71 | 1.66 |
| N-Acetyl-L-leucine | ME917624 | 0.80 | 0.59 | 0.94 | 0.50 | 0.57 | 1.40 | 1.74 | 0.94 | 1.27 | 0.63 | 0.67 | 0.59 | 1.28 | 1.73 | 0.89 | 0.57 | 1.02 | 1.53 | 0.81 | 0.91 | 1.61 | 0.75 | 1.63 | 1.18 | 1.18 | 0.86 | 1.04 | 1.16 | 1.74 | 1.40 | 1.22 | 0.58 | 0.85 | 0.82 | 0.63 | 1.68 | 0.74 | 0.93 | 0.59 | 0.91 | 0.71 | 0.58 | 0.64 | 0.35 | 0.56 | 1.05 | 1.16 | 0.60 | 1.25 | 1.74 | 1.74 | 1.50 | 1.61 |
| PG(16:1(9Z)/16:1(9Z)) | ME917739 | 1.08 | 0.76 | 0.86 | 0.71 | 0.73 | 0.95 | 0.83 | 0.96 | 0.92 | 0.99 | 0.95 | 0.83 | 0.87 | 0.82 | 0.86 | 0.94 | 1.30 | 0.93 | 0.79 | 1.12 | 0.98 | 1.11 | 0.96 | 1.17 | 1.06 | 0.73 | 0.88 | 0.89 | 1.30 | 0.84 | 1.06 | 1.17 | 1.18 | 0.90 | 0.75 | 1.20 | 0.89 | 0.87 | 0.82 | 0.86 | 1.05 | 0.99 | 0.86 | 1.00 | 0.72 | 0.93 | 0.81 | 0.82 | 1.62 | 2.21 | 2.28 | 2.39 | 0.94 |
| H2S2O3 | ME917621 | 0.82 | 0.87 | 0.89 | 0.80 | 0.82 | 0.93 | 0.95 | 0.99 | 0.69 | 0.90 | 0.92 | 0.80 | 1.11 | 1.39 | 1.01 | 0.88 | 1.05 | 1.35 | 0.94 | 1.03 | 1.73 | 0.85 | 1.03 | 0.90 | 0.80 | 0.87 | 1.00 | 1.13 | 0.85 | 1.01 | 0.99 | 0.87 | 0.85 | 0.95 | 0.91 | 0.91 | 0.82 | 0.86 | 0.86 | 0.94 | 0.79 | 0.84 | 0.94 | 0.87 | 0.77 | 0.97 | 1.03 | 0.88 | 1.47 | 1.71 | 1.69 | 1.76 | 1.45 |
| PI(32:3) | ME917845 | 0.81 | 0.73 | 0.90 | 0.66 | 0.76 | 1.06 | 1.47 | 0.89 | 1.08 | 0.81 | 0.85 | 0.72 | 1.15 | 1.55 | 0.95 | 0.67 | 0.89 | 1.23 | 0.79 | 0.85 | 1.36 | 0.94 | 1.19 | 0.89 | 0.98 | 0.91 | 0.93 | 0.86 | 1.27 | 1.02 | 0.98 | 0.69 | 0.79 | 0.89 | 0.72 | 1.22 | 0.82 | 0.89 | 0.83 | 0.95 | 0.87 | 0.81 | 0.83 | 0.66 | 0.69 | 0.93 | 1.00 | 0.75 | 1.57 | 1.96 | 2.06 | 1.99 | 1.46 |
| 4-Dodecylbenzenesulfonic Acid | ME917608 | 0.78 | 0.68 | 0.87 | 0.58 | 0.75 | 0.99 | 0.92 | 0.63 | 0.73 | 0.81 | 1.00 | 0.60 | 1.45 | 1.40 | 1.02 | 0.89 | 2.60 | 2.33 | 0.99 | 1.57 | 2.11 | 1.15 | 1.38 | 1.01 | 0.96 | 0.96 | 1.07 | 0.60 | 1.40 | 1.29 | 1.69 | 0.81 | 0.94 | 1.04 | 0.95 | 0.82 | 0.60 | 0.97 | 0.91 | 0.60 | 0.55 | 0.90 | 0.97 | 0.68 | 0.56 | 0.94 | 0.98 | 0.59 | 1.10 | 1.39 | 1.52 | 1.24 | 0.90 |
| FA (12:1) Decenedioic acid | ME917609 | 0.74 | 0.73 | 0.92 | 0.62 | 0.80 | 1.05 | 0.98 | 0.65 | 0.71 | 0.86 | 1.07 | 0.64 | 0.90 | 1.06 | 1.09 | 0.78 | 2.07 | 2.37 | 1.06 | 1.54 | 1.72 | 1.23 | 1.47 | 1.07 | 0.98 | 1.03 | 1.18 | 0.78 | 1.13 | 1.20 | 1.68 | 0.86 | 1.01 | 1.12 | 1.01 | 0.88 | 0.64 | 0.90 | 0.97 | 0.65 | 0.58 | 0.88 | 1.03 | 0.73 | 0.60 | 1.00 | 1.05 | 0.63 | 0.90 | 1.49 | 1.62 | 1.32 | 0.96 |
| 5-exo-Hydroxy-1,2-campholide | ME917936 | 0.48 | 0.35 | 0.48 | 0.17 | 0.63 | 0.79 | 0.77 | 0.66 | 0.81 | 0.60 | 0.69 | 0.52 | 1.45 | 1.66 | 1.59 | 1.57 | 1.94 | 2.09 | 1.18 | 1.49 | 2.39 | 1.21 | 1.79 | 1.29 | 1.55 | 1.20 | 1.46 | 1.41 | 1.50 | 1.31 | 1.35 | 0.93 | 1.00 | 0.89 | 0.84 | 1.15 | 0.54 | 0.71 | 0.59 | 0.50 | 0.65 | 0.67 | 0.71 | 0.66 | 0.33 | 0.99 | 0.74 | 0.81 | 1.45 | 1.69 | 1.67 | 1.61 | 1.49 |
| Ile-Ala-Thr | ME917569 | 0.87 | 0.44 | 0.83 | 0.36 | 0.52 | 1.31 | 1.18 | 0.91 | 0.99 | 0.57 | 0.48 | 0.48 | 1.60 | 1.70 | 0.92 | 0.74 | 2.18 | 2.55 | 0.91 | 1.39 | 1.58 | 0.83 | 1.37 | 1.37 | 1.77 | 0.97 | 1.13 | 1.36 | 1.51 | 1.48 | 1.58 | 0.65 | 0.82 | 0.85 | 0.60 | 1.39 | 0.61 | 0.87 | 0.57 | 0.95 | 0.63 | 0.55 | 0.67 | 0.57 | 0.41 | 1.05 | 0.85 | 0.57 | 1.40 | 1.55 | 1.54 | 1.77 | 1.63 |
| 1,8-Diazacyclotetradecane-2,9-dione | ME917686 | 0.87 | 0.40 | 0.79 | 0.35 | 0.47 | 1.29 | 1.17 | 0.80 | 1.10 | 0.47 | 0.49 | 0.49 | 1.57 | 1.68 | 0.90 | 0.80 | 1.93 | 2.47 | 0.81 | 1.37 | 1.93 | 0.75 | 1.51 | 1.34 | 1.62 | 1.08 | 1.14 | 1.39 | 1.63 | 1.56 | 1.73 | 0.63 | 0.71 | 0.84 | 0.59 | 1.52 | 0.69 | 0.95 | 0.57 | 1.01 | 0.67 | 0.56 | 0.60 | 0.57 | 0.37 | 0.92 | 0.94 | 0.58 | 1.36 | 1.62 | 1.66 | 1.70 | 1.76 |
| 3-Hydroxy-carbofuran | ME917694 | 0.84 | 0.39 | 0.75 | 0.32 | 0.46 | 1.28 | 1.19 | 0.79 | 1.09 | 0.50 | 0.48 | 0.45 | 1.90 | 1.69 | 0.97 | 0.74 | 2.06 | 2.55 | 0.89 | 1.47 | 1.88 | 0.77 | 1.41 | 1.36 | 1.68 | 1.01 | 1.12 | 1.29 | 1.50 | 1.57 | 1.80 | 0.63 | 0.82 | 0.89 | 0.54 | 1.42 | 0.71 | 0.98 | 0.54 | 1.01 | 0.77 | 0.51 | 0.64 | 0.55 | 0.39 | 0.98 | 0.86 | 0.53 | 1.49 | 1.52 | 1.56 | 1.63 | 1.62 |
| Fumarate | ME917864 | 0.60 | 0.47 | 0.65 | 0.46 | 0.58 | 0.82 | 1.61 | 1.25 | 0.70 | 0.83 | 1.30 | 1.06 | 0.82 | 0.75 | 1.54 | 1.14 | 1.15 | 1.29 | 1.47 | 1.55 | 1.31 | 1.40 | 1.74 | 1.51 | 0.77 | 0.59 | 1.09 | 1.10 | 1.20 | 1.06 | 2.14 | 1.52 | 1.08 | 0.85 | 1.20 | 1.29 | 0.58 | 0.53 | 0.74 | 0.62 | 0.61 | 0.49 | 1.54 | 0.82 | 0.37 | 0.87 | 0.93 | 1.38 | 1.16 | 1.37 | 1.27 | 1.29 | 1.05 |
| Ursodiol | ME917793 | 1.29 | 1.55 | 1.22 | 1.10 | 1.03 | 1.73 | 1.04 | 1.15 | 1.55 | 1.39 | 0.99 | 0.79 | 0.87 | 0.97 | 1.14 | 1.13 | 1.28 | 1.50 | 1.30 | 1.62 | 1.29 | 1.49 | 1.27 | 1.05 | 0.94 | 0.79 | 0.91 | 0.94 | 1.16 | 1.47 | 1.61 | 1.58 | 1.39 | 1.78 | 1.49 | 0.92 | 0.66 | 0.78 | 0.66 | 0.53 | 0.60 | 0.71 | 0.67 | 1.17 | 0.58 | 1.26 | 1.29 | 0.78 | 0.84 | 0.37 | 0.36 | 1.08 | 0.47 |
| (S)-Malate | ME917618 | 1.70 | 0.74 | 1.38 | 0.72 | 0.50 | 0.96 | 0.97 | 0.76 | 0.54 | 1.26 | 0.81 | 0.86 | 1.44 | 0.73 | 0.70 | 0.51 | 1.03 | 0.55 | 0.70 | 1.11 | 1.03 | 1.20 | 0.82 | 1.01 | 0.99 | 0.55 | 0.44 | 0.94 | 1.35 | 1.44 | 1.08 | 0.68 | 0.93 | 1.02 | 1.03 | 1.10 | 1.16 | 1.53 | 0.76 | 1.24 | 0.89 | 1.11 | 1.29 | 1.03 | 0.63 | 1.05 | 1.02 | 1.60 | 2.32 | 0.91 | 1.23 | 1.26 | 1.19 |
| 2-(Acetamidomethylene)succinate | ME917783 | 1.58 | 1.26 | 1.32 | 0.82 | 1.20 | 1.40 | 1.15 | 1.05 | 1.72 | 0.96 | 1.25 | 1.13 | 0.77 | 0.51 | 0.49 | 0.82 | 0.79 | 1.36 | 0.80 | 0.75 | 0.68 | 0.86 | 0.87 | 0.69 | 0.54 | 0.63 | 0.75 | 0.62 | 0.51 | 0.53 | 0.71 | 0.51 | 1.31 | 1.24 | 1.06 | 1.18 | 0.65 | 1.03 | 0.71 | 0.78 | 0.82 | 0.93 | 0.98 | 1.67 | 0.81 | 1.40 | 1.41 | 1.04 | 1.58 | 1.47 | 1.43 | 1.41 | 1.04 |
| Ala-Asp-Asp-Gln | ME917841 | 1.65 | 1.25 | 1.10 | 0.84 | 0.96 | 1.02 | 0.49 | 0.97 | 1.43 | 0.94 | 1.06 | 0.72 | 0.69 | 0.43 | 0.37 | 0.83 | 1.49 | 1.15 | 0.52 | 0.86 | 1.19 | 1.29 | 1.15 | 1.00 | 1.20 | 1.06 | 0.71 | 0.48 | 0.98 | 1.01 | 1.03 | 1.07 | 1.95 | 1.73 | 1.23 | 1.61 | 0.52 | 1.44 | 0.67 | 0.79 | 1.01 | 0.89 | 0.83 | 1.19 | 1.06 | 1.40 | 1.17 | 1.24 | 1.33 | 0.83 | 0.90 | 0.91 | 1.14 |
| D-Glucose | ME917680 | 1.75 | 1.66 | 1.39 | 1.10 | 0.85 | 0.97 | 0.68 | 0.94 | 1.18 | 1.12 | 1.10 | 1.04 | 0.72 | 0.66 | 0.66 | 0.79 | 1.03 | 0.92 | 0.82 | 0.94 | 1.03 | 1.11 | 1.36 | 1.39 | 0.97 | 0.84 | 0.75 | 0.83 | 1.15 | 0.89 | 1.09 | 0.97 | 1.51 | 1.37 | 1.25 | 1.53 | 0.77 | 1.19 | 0.81 | 0.67 | 0.91 | 0.82 | 0.82 | 1.15 | 0.72 | 1.16 | 1.28 | 1.16 | 1.25 | 1.38 | 1.29 | 1.21 | 1.13 |
| PG(32:1) | ME917676 | 1.74 | 1.61 | 1.41 | 1.11 | 0.87 | 1.03 | 0.68 | 1.01 | 1.23 | 1.17 | 1.15 | 1.02 | 0.75 | 0.66 | 0.66 | 0.79 | 1.10 | 0.76 | 0.82 | 1.02 | 1.07 | 1.02 | 1.48 | 1.29 | 0.83 | 0.89 | 0.75 | 0.83 | 1.15 | 0.89 | 1.12 | 0.97 | 1.52 | 1.39 | 1.29 | 1.54 | 0.77 | 1.20 | 0.82 | 0.73 | 0.91 | 0.82 | 0.82 | 1.15 | 0.76 | 1.16 | 1.29 | 1.17 | 1.19 | 1.25 | 1.15 | 1.16 | 1.12 |
| dAMP | ME917978 | 0.99 | 0.53 | 0.71 | 0.31 | 0.73 | 1.17 | 0.60 | 0.93 | 1.12 | 0.72 | 1.13 | 0.74 | 0.84 | 0.86 | 0.95 | 0.99 | 1.39 | 1.16 | 1.31 | 1.52 | 1.08 | 1.20 | 1.28 | 1.39 | 1.29 | 0.93 | 1.10 | 1.13 | 1.65 | 1.49 | 1.77 | 1.63 | 1.75 | 1.25 | 1.38 | 1.40 | 0.54 | 1.05 | 0.77 | 0.40 | 0.56 | 0.64 | 0.74 | 0.80 | 0.55 | 1.08 | 0.94 | 0.77 | 1.13 | 0.45 | 0.42 | 0.71 | 1.02 |
| Gentisin | ME917723 | 0.96 | 0.63 | 0.69 | 0.33 | 0.85 | 1.19 | 0.64 | 0.83 | 1.09 | 0.79 | 1.09 | 0.79 | 0.96 | 1.02 | 1.01 | 1.03 | 1.14 | 1.07 | 1.23 | 1.47 | 1.02 | 0.94 | 1.28 | 1.37 | 1.21 | 0.93 | 1.13 | 1.23 | 1.54 | 1.46 | 1.71 | 1.58 | 1.57 | 1.22 | 1.40 | 1.42 | 0.61 | 1.02 | 0.75 | 0.39 | 0.55 | 0.69 | 0.72 | 0.78 | 0.65 | 0.97 | 1.00 | 0.68 | 1.23 | 0.65 | 0.71 | 0.68 | 1.10 |
| cis-Aconitate | ME917666 | 0.86 | 0.60 | 0.68 | 0.96 | 1.13 | 1.25 | 0.81 | 1.22 | 1.06 | 0.98 | 0.98 | 0.84 | 0.75 | 0.82 | 0.74 | 0.80 | 1.26 | 1.05 | 1.13 | 1.44 | 1.12 | 1.17 | 1.41 | 1.39 | 1.04 | 0.62 | 0.63 | 0.74 | 1.27 | 1.18 | 1.26 | 1.14 | 1.42 | 1.17 | 1.50 | 1.35 | 0.61 | 0.94 | 0.77 | 0.61 | 0.38 | 0.52 | 0.65 | 1.24 | 0.79 | 1.29 | 0.87 | 0.88 | 1.15 | 1.26 | 1.05 | 1.11 | 1.12 |
| 2-oxobut-3-enanoate | ME917758 | 0.49 | 0.43 | 0.46 | 0.50 | 0.90 | 1.24 | 1.08 | 1.09 | 1.14 | 0.63 | 1.13 | 0.69 | 1.08 | 0.94 | 1.00 | 0.90 | 1.66 | 1.06 | 1.03 | 1.20 | 1.40 | 1.06 | 1.11 | 1.05 | 1.11 | 1.01 | 1.17 | 1.01 | 1.18 | 1.13 | 1.34 | 1.22 | 1.71 | 1.12 | 1.43 | 1.48 | 0.87 | 0.89 | 0.73 | 0.67 | 0.65 | 0.74 | 0.83 | 1.14 | 0.72 | 0.85 | 0.86 | 0.97 | 1.45 | 1.06 | 1.03 | 1.12 | 1.23 |
| 2-Oxoglutaramate | ME917787 | 0.49 | 0.39 | 0.50 | 0.47 | 0.96 | 1.23 | 1.15 | 0.94 | 0.96 | 0.63 | 1.00 | 0.74 | 0.80 | 0.94 | 0.96 | 0.87 | 1.45 | 1.08 | 0.96 | 1.26 | 1.22 | 0.91 | 1.20 | 1.11 | 1.22 | 1.12 | 1.34 | 1.05 | 1.33 | 1.15 | 1.38 | 1.05 | 1.55 | 1.07 | 1.33 | 1.44 | 0.77 | 0.83 | 0.88 | 0.66 | 0.68 | 0.76 | 0.93 | 0.93 | 0.72 | 0.93 | 0.88 | 0.93 | 1.32 | 1.04 | 1.10 | 1.07 | 1.32 |
| 2-Oxobutanoate | ME917995 | 0.79 | 0.95 | 0.78 | 1.68 | 1.03 | 0.84 | 1.10 | 0.81 | 1.10 | 1.14 | 0.80 | 1.35 | 1.45 | 1.44 | 1.11 | 1.19 | 0.77 | 0.97 | 1.59 | 0.82 | 0.75 | 1.32 | 0.95 | 1.02 | 0.81 | 1.03 | 1.25 | 0.95 | 0.75 | 0.99 | 1.17 | 1.28 | 0.75 | 0.95 | 0.93 | 0.95 | 0.77 | 0.72 | 1.09 | 1.48 | 0.87 | 0.86 | 0.77 | 1.20 | 1.66 | 0.79 | 1.10 | 0.90 | 1.24 | 1.09 | 1.31 | 1.15 | 1.18 |
| N-Acetylneuraminate | ME917769 | 0.91 | 1.04 | 1.03 | 1.85 | 1.12 | 1.02 | 0.94 | 1.05 | 1.03 | 0.91 | 0.96 | 1.02 | 0.75 | 0.81 | 1.01 | 1.02 | 1.02 | 0.87 | 0.81 | 1.11 | 1.03 | 1.00 | 1.15 | 0.81 | 1.22 | 0.89 | 0.78 | 1.09 | 1.09 | 0.98 | 1.10 | 1.01 | 0.94 | 0.92 | 0.95 | 0.94 | 1.17 | 0.99 | 0.99 | 0.96 | 1.10 | 1.06 | 1.06 | 0.95 | 2.05 | 1.07 | 1.01 | 0.90 | 0.74 | 1.10 | 0.95 | 1.00 | 0.93 |
| Mannitol | ME917826 | 1.26 | 0.59 | 0.90 | 0.72 | 0.82 | 1.18 | 0.74 | 0.89 | 0.81 | 0.91 | 1.09 | 1.00 | 1.02 | 0.83 | 0.81 | 0.91 | 1.56 | 0.89 | 1.10 | 1.30 | 0.79 | 0.98 | 1.26 | 1.67 | 1.07 | 0.67 | 0.78 | 1.20 | 1.23 | 1.01 | 1.04 | 0.72 | 1.46 | 1.08 | 1.39 | 1.32 | 1.00 | 1.05 | 1.00 | 0.79 | 0.87 | 1.06 | 1.05 | 0.91 | NA | 0.97 | 1.02 | 0.80 | 0.49 | 1.37 | 1.64 | 1.73 | 1.17 |
| Asp-Asp-Asp-Pro | ME917837 | 0.90 | 0.84 | 1.06 | 0.71 | 1.08 | 1.30 | 1.39 | 0.89 | 1.08 | 0.79 | 1.04 | 0.88 | 1.14 | 1.19 | 0.67 | 1.10 | 1.06 | 1.32 | 0.83 | 0.95 | 1.03 | 0.93 | 1.25 | 0.70 | 1.06 | 0.83 | 1.14 | 1.14 | 1.01 | 0.94 | 0.50 | 1.16 | 0.73 | 1.27 | 0.70 | 0.94 | 1.07 | 0.93 | 0.84 | 1.13 | 0.91 | 1.09 | 0.97 | 0.99 | 0.69 | 0.91 | 1.15 | 0.92 | 2.10 | 0.94 | 0.93 | 0.93 | 0.98 |
| FA hydroxy (18:2) | ME917802 | 0.54 | 1.11 | 0.87 | 0.69 | 1.08 | 1.07 | 1.02 | 1.08 | 1.40 | 1.34 | 0.81 | 1.03 | 0.92 | 0.92 | 0.94 | 0.84 | 1.04 | 1.35 | 0.90 | 1.23 | 1.19 | 1.04 | 1.02 | 1.40 | 1.24 | 1.14 | 1.07 | 1.29 | 0.95 | 1.11 | 1.19 | 1.15 | 1.30 | 1.43 | 0.89 | 1.25 | 0.51 | 0.51 | 1.06 | 0.80 | 1.37 | 1.03 | 1.00 | 0.88 | 1.11 | 1.10 | 1.02 | 0.99 | 0.43 | 1.38 | 1.00 | 1.50 | 1.08 |
| (1S,3R,4S)-3,4-Dihydroxycyclohexane-1-carboxylate | ME917691 | 1.24 | 0.87 | 0.97 | 1.14 | 0.87 | 1.13 | 0.79 | 1.12 | 0.66 | 1.11 | 1.33 | 1.14 | 0.73 | 0.86 | 1.05 | 0.71 | 0.97 | 0.95 | 1.07 | 1.22 | 1.02 | 0.78 | 1.02 | 1.20 | 1.20 | 1.00 | 0.82 | 1.05 | 1.43 | 0.88 | 0.75 | 0.90 | 1.64 | 0.97 | 1.11 | 1.14 | 0.79 | 1.35 | 0.87 | 0.83 | 0.77 | 1.12 | 1.05 | 0.95 | 0.79 | 1.41 | 0.95 | 1.18 | 2.16 | 1.37 | 1.29 | 1.11 | 0.93 |
| Lithocholate3-O-glucuronide | ME917856 | 1.28 | 1.02 | 0.92 | 0.94 | 0.99 | 0.97 | 1.00 | 1.20 | 0.86 | 1.02 | 0.87 | 0.91 | 0.80 | 1.08 | 1.12 | 0.94 | 1.08 | 1.05 | 1.04 | 0.84 | 1.14 | 0.94 | 1.02 | 1.07 | 1.24 | 0.82 | 0.91 | 0.96 | 1.02 | 1.10 | 0.92 | 0.89 | 1.00 | 0.88 | 0.98 | 1.18 | 0.93 | 1.12 | 0.98 | 0.84 | 0.99 | 1.01 | 0.95 | 1.27 | 0.70 | 0.97 | 1.06 | 1.05 | 1.79 | 0.95 | 0.99 | 0.97 | 1.11 |
| PG(34:1) | ME917641 | 1.10 | 0.95 | 0.95 | 0.93 | 0.92 | 1.32 | 0.72 | 0.95 | 0.92 | 0.93 | 1.04 | 0.95 | 0.81 | 0.79 | 0.86 | 0.74 | 0.97 | 0.95 | 1.02 | 0.96 | 0.88 | 1.21 | 0.94 | 1.16 | 0.94 | 0.84 | 0.79 | 0.69 | 1.12 | 1.09 | 0.98 | 0.90 | 1.37 | 1.15 | 1.13 | 1.16 | 0.95 | 0.99 | 0.90 | 0.87 | 0.73 | 0.82 | 0.66 | 1.65 | 0.65 | 1.16 | 1.13 | 1.12 | 1.39 | 1.24 | 1.20 | 1.26 | 1.13 |
| (S)-2-Aceto-2-hydroxybutanoate | ME917714 | 1.29 | 1.04 | 1.06 | 0.76 | 1.05 | 0.97 | 0.85 | 0.95 | 0.50 | 1.25 | 0.79 | 1.24 | 1.07 | 1.18 | 1.18 | 1.10 | 0.99 | 1.59 | 0.88 | 0.98 | 1.06 | 0.99 | 1.20 | 1.25 | 0.96 | 0.98 | 1.11 | 0.85 | 0.87 | 1.09 | 0.96 | 1.29 | 1.01 | 1.26 | 1.08 | 1.18 | 1.22 | 0.89 | 1.12 | 1.57 | 1.15 | 1.00 | 1.15 | 0.86 | 0.55 | 1.13 | 1.38 | 0.93 | 0.81 | 1.22 | 1.30 | 1.40 | 1.03 |
| Bicozamycin | ME918000 | 0.98 | 0.73 | 0.82 | 0.72 | 0.91 | 0.83 | 0.82 | 0.81 | 1.04 | 0.89 | 0.98 | 0.90 | 0.64 | 0.78 | 0.82 | 0.75 | 0.80 | 0.70 | 0.76 | 1.03 | 0.90 | 0.85 | 0.88 | 0.82 | 0.82 | 0.79 | 0.90 | 0.87 | 0.80 | 0.80 | 0.79 | 0.68 | 0.96 | 0.95 | 0.88 | 0.82 | 1.04 | 0.74 | 0.84 | 0.67 | 0.82 | 0.89 | 0.79 | 0.75 | 0.76 | 0.79 | 0.96 | 0.97 | 0.84 | 1.42 | 1.32 | 1.33 | 0.85 |
| Clodronate | ME917719 | 0.84 | 1.21 | 0.82 | 1.22 | 1.28 | 1.04 | 1.18 | 0.93 | 0.97 | 1.05 | 1.01 | 0.80 | 0.82 | 0.97 | 1.00 | 0.86 | 1.10 | 1.18 | 1.03 | 1.27 | 1.15 | 0.95 | 0.76 | 0.85 | 1.20 | 0.87 | 1.05 | 0.98 | 0.99 | 1.06 | 1.09 | 0.95 | 0.89 | 1.03 | 1.07 | 0.83 | 1.06 | 0.91 | 1.06 | 1.05 | 1.03 | 1.32 | 1.02 | 1.00 | 1.00 | 1.37 | 0.98 | 1.15 | 0.62 | 1.01 | 1.08 | 1.12 | 0.83 |
| Cyclic ADP-ribose | ME917829 | 0.96 | 1.09 | 1.03 | 0.56 | 1.20 | 1.12 | 0.82 | 1.18 | 1.10 | 0.99 | 1.01 | 1.14 | 0.73 | 1.00 | 1.18 | 1.00 | 0.86 | 0.98 | 0.99 | 0.99 | 1.08 | 1.01 | 1.02 | 0.87 | 1.02 | 1.10 | 0.99 | 1.06 | 0.93 | 1.12 | 1.10 | 0.96 | 1.03 | 1.04 | 1.11 | 1.02 | 1.19 | 1.11 | 1.05 | 1.11 | 1.32 | 1.08 | 1.18 | 1.01 | 0.43 | 1.11 | 1.01 | 1.06 | 0.65 | 1.27 | 1.46 | 1.24 | 1.01 |
| Gentisate aldehyde | ME917709 | 0.93 | 1.15 | 0.95 | 0.83 | 1.09 | 1.09 | 1.02 | 1.07 | 1.08 | 1.16 | 1.08 | 1.11 | 1.08 | 1.08 | 1.11 | 1.15 | 0.96 | 1.04 | 0.95 | 1.10 | 0.99 | 1.21 | 1.05 | 1.06 | 1.09 | 1.07 | 1.14 | 1.02 | 0.99 | 1.08 | 1.01 | 1.13 | 1.09 | 1.06 | 1.08 | 1.11 | 1.05 | 1.07 | 1.09 | 1.07 | 1.06 | 1.05 | 1.00 | 1.03 | 0.67 | 1.07 | 1.10 | 1.09 | 1.17 | 1.46 | 1.39 | 1.43 | 1.17 |
| FA (18:2) | ME917665 | 0.85 | 0.93 | 0.98 | 0.81 | 1.16 | 1.25 | 1.01 | 0.97 | 1.26 | 1.28 | 0.96 | 0.96 | 1.02 | 0.88 | 1.12 | 0.85 | 0.99 | 1.02 | 1.03 | 1.22 | 0.96 | 1.13 | 0.87 | 1.00 | 0.86 | 1.08 | 1.03 | 0.92 | 0.96 | 1.14 | 0.89 | 0.92 | 0.87 | 1.06 | 1.10 | 0.76 | 1.00 | 1.02 | 1.00 | 0.92 | 1.01 | 0.83 | 1.04 | 1.02 | 0.83 | 1.04 | 1.02 | 1.12 | 0.87 | 0.99 | 1.06 | 1.07 | 1.23 |
| (Ac)2-L-Lys-D-Ala | ME917994 | 1.01 | 0.95 | 0.93 | 1.32 | 0.94 | 0.96 | 0.91 | 1.05 | 0.89 | 0.97 | 0.92 | 0.98 | 0.96 | 0.92 | 0.88 | 0.97 | 0.85 | 0.83 | 1.13 | 0.96 | 0.92 | 0.95 | 0.94 | 0.92 | 0.92 | 0.98 | 1.06 | 0.87 | 0.84 | 0.93 | 0.99 | 0.89 | 0.95 | 1.05 | 0.92 | 1.14 | 0.94 | 0.99 | 0.90 | 0.98 | 1.02 | 0.92 | 1.11 | 1.12 | 0.91 | 0.83 | 0.99 | 1.02 | 0.86 | 1.39 | 1.31 | 1.23 | 1.02 |
| Pyrophosphate | ME917863 | 0.92 | 0.90 | 0.96 | 1.08 | 1.13 | 0.95 | 0.90 | 1.07 | 0.89 | 0.89 | 1.06 | 0.86 | 0.91 | 0.95 | 0.96 | 0.89 | 0.97 | 1.06 | 1.09 | 1.11 | 0.87 | 0.87 | 0.96 | 0.96 | 0.99 | 0.93 | 0.97 | 1.04 | 0.93 | 1.02 | 1.03 | 0.89 | 0.91 | 1.05 | 1.28 | 0.87 | 1.14 | 1.10 | 0.96 | 0.85 | 0.95 | 1.08 | 1.11 | 1.02 | 1.14 | 1.05 | 1.09 | 0.96 | 1.02 | 1.22 | 1.09 | 1.12 | 1.04 |
| Pyruvate | ME917805 | 1.09 | 0.98 | 0.97 | 0.85 | 1.06 | 0.98 | 1.06 | 1.01 | 1.10 | 0.94 | 1.01 | 1.06 | 1.03 | 1.01 | 1.02 | 1.03 | 1.09 | 0.99 | 1.09 | 0.98 | 0.96 | 1.02 | 0.91 | 0.96 | 1.06 | 0.99 | 0.97 | 1.07 | 1.03 | 1.03 | 1.01 | 0.97 | 0.95 | 0.97 | 1.07 | 0.99 | 1.03 | 1.05 | 1.05 | 1.11 | 1.14 | 0.99 | 1.01 | 0.97 | 0.91 | 1.12 | 1.03 | 1.06 | 1.09 | 1.06 | 1.17 | 1.01 | 0.99 |
| Lactose | ME917619 | 0.91 | 0.72 | 0.93 | 0.71 | 0.78 | 1.24 | 1.32 | 0.95 | 0.94 | 0.92 | 0.82 | 0.81 | 1.19 | 1.18 | 1.09 | 0.87 | 1.22 | 1.30 | 0.96 | 1.05 | 1.23 | 0.97 | 1.18 | 1.23 | 1.19 | 1.06 | 1.12 | 0.96 | 1.23 | 1.17 | 1.15 | 0.86 | 1.06 | 0.92 | 0.82 | 1.33 | 0.83 | 0.99 | 0.78 | 0.99 | 0.86 | 0.79 | 0.82 | 0.83 | 0.80 | 1.01 | 1.15 | 0.80 | 0.95 | 1.08 | 1.08 | 1.09 | 1.07 |
| beta-Alanyl-L-lysine | ME917682 | 0.98 | 1.05 | 1.25 | 0.96 | 0.96 | 1.11 | 1.13 | 0.97 | 0.85 | 1.06 | 1.16 | 0.97 | 0.90 | 1.08 | 1.12 | 0.91 | 0.86 | 1.06 | 1.01 | 0.96 | 0.93 | 1.07 | 1.04 | 0.92 | 0.88 | 1.11 | 1.08 | 0.93 | 0.93 | 1.10 | 1.10 | 0.92 | 0.91 | 1.13 | 1.03 | 0.93 | 0.98 | 1.03 | 1.10 | 0.95 | 0.84 | 1.11 | 1.14 | 0.96 | 0.85 | 1.11 | 1.14 | 0.99 | 0.49 | 1.06 | 1.20 | 1.02 | 0.96 |
| Trimetaphosphate | ME917662 | 0.79 | 1.06 | 1.24 | 0.80 | 0.89 | 1.10 | 1.21 | 0.79 | 0.69 | 1.16 | 1.26 | 0.81 | 0.91 | 1.19 | 1.37 | 0.84 | 0.77 | 1.11 | 1.14 | 0.95 | 0.91 | 1.21 | 1.18 | 0.88 | 0.76 | 1.15 | 1.41 | 0.79 | 0.94 | 1.15 | 1.30 | 0.93 | 0.89 | 1.27 | 1.13 | 0.86 | 0.83 | 1.02 | 1.09 | 0.85 | 0.71 | 1.18 | 1.30 | 0.79 | 0.77 | 1.18 | 1.30 | 0.81 | 0.59 | 1.09 | 1.29 | 1.02 | 0.81 |
| (S)-2-Acetolactate | ME917731 | 0.88 | 0.87 | 1.01 | 0.65 | 0.97 | 1.12 | 1.10 | 0.79 | 0.82 | 1.00 | 1.12 | 0.76 | 1.01 | 1.14 | 1.32 | 1.00 | 1.09 | 1.24 | 1.26 | 1.07 | 1.17 | 1.30 | 1.23 | 1.10 | 0.91 | 1.07 | 1.23 | 0.96 | 1.06 | 1.25 | 1.33 | 1.01 | 1.07 | 1.18 | 1.17 | 1.06 | 0.75 | 0.95 | 1.02 | 0.69 | 0.66 | 1.02 | 1.12 | 0.82 | 0.75 | 1.09 | 1.12 | 0.81 | 0.78 | 1.19 | 1.31 | 1.02 | 0.89 |
| (-)-Menthol | ME917670 | 0.92 | 0.89 | 1.06 | 0.78 | 0.87 | 1.15 | 1.14 | 0.82 | 0.78 | 1.04 | 0.98 | 0.81 | 0.99 | 1.31 | 1.16 | 0.87 | 1.01 | 1.36 | 1.04 | 1.02 | 1.43 | 1.19 | 1.27 | 0.92 | 0.86 | 1.03 | 1.18 | 0.90 | 1.02 | 1.11 | 1.21 | 0.90 | 0.97 | 1.06 | 0.99 | 1.09 | 0.80 | 0.96 | 0.97 | 0.79 | 0.70 | 1.02 | 0.99 | 0.80 | 0.73 | 1.07 | 1.16 | 0.76 | 0.84 | 1.31 | 1.36 | 1.33 | 1.08 |
| trans-Hexadec-2-enoyl-CoA | ME917840 | 0.93 | 0.89 | 1.08 | 0.81 | 0.93 | 1.10 | 1.11 | 0.91 | 0.87 | 0.92 | 1.04 | 0.89 | 0.99 | 1.15 | 1.12 | 0.82 | 0.91 | 1.05 | 0.97 | 0.94 | 1.12 | 1.15 | 1.19 | 0.99 | 0.88 | 1.01 | 1.12 | 1.00 | 1.05 | 0.99 | 1.11 | 0.85 | 0.97 | 1.09 | 0.92 | 1.05 | 0.83 | 1.00 | 1.01 | 0.99 | 0.89 | 0.99 | 1.02 | 0.81 | 0.84 | 1.10 | 1.22 | 0.86 | 1.03 | 1.24 | 1.36 | 1.30 | 1.04 |
| 20-Trihydroxy-leukotriene-B4 | ME917852 | 1.38 | 1.06 | 1.21 | 0.76 | 1.02 | 1.00 | 0.75 | 0.93 | 1.26 | 0.82 | 1.11 | 0.91 | 0.69 | 0.64 | 0.82 | 0.79 | 1.33 | 1.24 | 0.82 | 1.11 | 1.23 | 0.80 | 1.18 | 1.04 | 1.00 | 0.86 | 0.80 | 0.84 | 1.28 | 0.91 | 0.92 | 0.94 | 1.19 | 1.27 | 1.35 | 1.18 | 1.28 | 1.20 | 1.04 | 0.70 | 1.20 | 1.18 | 1.18 | 0.74 | 0.60 | 1.22 | 0.99 | 1.07 | 0.40 | 1.21 | 1.22 | 1.16 | 1.03 |
| FA (14:1) tetradecenoic acid | ME917855 | 1.36 | 0.86 | 1.24 | 0.55 | 0.98 | 0.97 | 0.72 | 0.97 | 1.22 | 0.79 | 1.32 | 0.73 | 0.67 | 0.62 | 0.79 | 0.76 | 1.53 | 1.20 | 0.79 | 1.08 | 1.19 | 0.78 | 1.14 | 1.27 | 0.90 | 0.86 | 0.77 | 0.98 | 1.23 | 0.88 | 0.93 | 0.91 | 1.12 | 1.06 | 1.31 | 1.04 | 1.02 | 1.58 | 0.93 | 0.68 | 1.00 | 1.22 | 1.14 | 0.83 | 0.58 | 1.18 | 0.92 | 1.03 | 1.21 | 1.30 | 1.35 | 1.28 | 1.11 |
| LysoPA(18:2) | ME917540 | 1.16 | NA | 1.09 | 0.84 | 1.00 | 1.09 | 0.87 | 1.07 | 1.01 | 1.06 | 1.18 | 1.06 | 0.81 | 0.48 | 0.93 | 0.94 | 1.20 | 0.91 | 0.84 | 1.14 | 1.07 | 0.90 | 1.09 | 1.24 | 1.08 | 0.94 | 0.94 | 1.02 | 1.28 | 1.01 | 0.98 | 0.91 | 1.20 | 1.05 | 1.09 | 1.17 | 1.09 | 1.20 | 1.05 | 0.87 | 1.08 | 1.09 | 1.13 | 1.01 | 0.63 | 1.09 | 1.09 | 1.16 | 1.08 | 1.24 | 1.18 | 1.23 | 1.14 |
| 3-(4-Hydroxyphenyl)pyruvate | ME917754 | 1.15 | 0.82 | 1.23 | 0.83 | 0.91 | 1.10 | 0.90 | 1.05 | 0.97 | 0.99 | 1.23 | 0.80 | 0.84 | 0.88 | 0.95 | 0.66 | 1.17 | 0.88 | 0.92 | 1.23 | 1.05 | 0.98 | 1.28 | 0.96 | 1.01 | 0.99 | 1.43 | 1.12 | 1.18 | 1.26 | 1.11 | 0.77 | 1.14 | 0.87 | 1.02 | 1.29 | 0.96 | 1.14 | 0.95 | 1.10 | 1.02 | 1.09 | 1.09 | 1.00 | 0.85 | 0.96 | 1.06 | 1.05 | 0.98 | 1.05 | 0.94 | 1.23 | 1.33 |
| Gamma-Glutamylglutamine | ME917543 | 1.27 | 1.03 | 1.19 | 0.64 | 1.05 | 1.14 | 0.91 | 1.12 | 1.05 | 1.11 | 1.23 | 1.11 | 0.85 | 0.77 | 0.97 | 0.99 | 1.30 | 0.97 | 0.88 | 1.19 | 1.04 | 0.98 | 1.14 | 1.35 | 1.13 | 0.98 | 0.99 | 1.08 | 1.34 | 1.05 | 1.03 | 0.95 | 1.26 | 1.09 | 1.17 | 1.29 | 1.14 | 1.25 | 1.08 | 0.91 | 1.13 | 1.17 | 1.18 | 1.05 | 0.77 | 1.12 | 1.14 | 1.22 | 1.14 | 1.30 | 1.23 | 1.28 | 1.19 |
| 2-C-Methyl-D-erythritol 4-phosphate | ME917551 | 0.28 | 0.18 | 0.27 | 0.06 | 0.28 | 0.67 | 0.28 | 0.41 | 0.82 | 0.28 | 0.40 | 0.15 | 0.45 | 0.72 | 0.50 | 0.49 | 1.87 | 2.61 | 1.23 | 1.28 | 3.19 | 1.91 | 2.28 | 1.95 | 1.02 | 0.61 | 0.61 | 0.80 | 1.68 | 2.30 | 1.90 | 1.44 | 1.93 | 1.30 | 1.54 | 2.89 | 0.12 | 0.37 | 0.18 | 0.12 | 0.24 | 0.25 | 0.30 | 0.32 | 0.30 | 1.19 | 0.95 | 0.25 | 1.40 | 1.67 | 1.72 | 1.65 | 1.41 |
| D-Glucosamine 6-phosphate | ME917580 | 0.09 | NA | NA | NA | 0.41 | 0.79 | 0.22 | 0.40 | 1.05 | 0.36 | 0.61 | 0.32 | 0.32 | 0.42 | 0.30 | 0.46 | 1.35 | 1.31 | 0.92 | 0.83 | 2.30 | 1.57 | 2.63 | 1.90 | 1.00 | 0.63 | 0.52 | 0.63 | 1.75 | 2.15 | 1.86 | 1.37 | 2.70 | 1.54 | 1.51 | 2.38 | 0.18 | 0.41 | 0.25 | 0.08 | 0.09 | 0.22 | 0.21 | 0.24 | 0.46 | 1.14 | 0.89 | 0.37 | 1.32 | 2.03 | 2.13 | 2.00 | 1.34 |
| Phe-Tyr | ME917575 | 0.09 | NA | NA | NA | 0.42 | 0.88 | 0.28 | 0.44 | 1.05 | 0.43 | 0.57 | 0.23 | 0.34 | 0.48 | 0.32 | 0.43 | 1.26 | 1.43 | 0.90 | 0.78 | 2.14 | 1.57 | 2.44 | 1.79 | 0.95 | 0.61 | 0.57 | 0.58 | 1.89 | 2.24 | 2.03 | 1.40 | 2.73 | 1.60 | 1.58 | 2.38 | 0.17 | 0.38 | 0.24 | 0.08 | 0.09 | 0.20 | 0.20 | 0.22 | 0.44 | 1.10 | 0.87 | 0.39 | 1.40 | 1.97 | 2.17 | 1.95 | 1.30 |
| Glu-Pro | ME917984 | NA | NA | NA | NA | 0.33 | 0.51 | 0.41 | 0.39 | 0.65 | 0.38 | 0.58 | 0.33 | 1.03 | 1.14 | 0.61 | 1.04 | 1.85 | 2.32 | 1.43 | 1.57 | 3.49 | 1.69 | 2.78 | 2.03 | 0.82 | 0.62 | 0.91 | 0.94 | 1.13 | 1.31 | 1.81 | 1.24 | 1.23 | 0.94 | 1.17 | 1.63 | 0.13 | 0.27 | 0.14 | 0.14 | 0.13 | 0.08 | 0.14 | 0.12 | 0.28 | 0.58 | 0.54 | 0.38 | 1.48 | 1.62 | 1.58 | 1.74 | 1.32 |
| 2-Oxoglutarate | ME917629 | 0.51 | 0.21 | 0.28 | 0.10 | 0.37 | 0.71 | 0.49 | 0.53 | 0.73 | 0.41 | 0.76 | 0.48 | 1.24 | 1.03 | 0.72 | 1.09 | 1.61 | 2.49 | 1.21 | 1.34 | 2.94 | 2.28 | 3.70 | 2.71 | 0.88 | 0.51 | 0.92 | 0.83 | 1.72 | 0.97 | 1.66 | 1.11 | 1.86 | 1.43 | 1.69 | 2.73 | 0.22 | 0.51 | 0.32 | 0.18 | 0.24 | 0.25 | 0.36 | 0.38 | 0.26 | 0.95 | 0.97 | 0.52 | 1.72 | 1.79 | 1.73 | 1.76 | 1.38 |
| 2 -(Butylamido)-4-hydroxybutanoic acid | ME917636 | 0.51 | 0.21 | 0.28 | 0.10 | 0.37 | 0.71 | 0.48 | 0.53 | 0.89 | 0.45 | 0.76 | 0.50 | 1.23 | 1.03 | 0.72 | 1.09 | 1.59 | 2.13 | 1.12 | 1.34 | 2.87 | 2.02 | 3.30 | 2.69 | 0.89 | 0.62 | 0.97 | 0.97 | 1.69 | 1.13 | 1.66 | 1.15 | 2.04 | 1.43 | 1.96 | 2.67 | 0.22 | 0.51 | 0.32 | 0.18 | 0.29 | 0.28 | 0.41 | 0.38 | 0.26 | 0.95 | 0.97 | 0.51 | 1.77 | 1.79 | 1.73 | 1.75 | 1.38 |
| FA (18:1) | ME917911 | 0.63 | 0.27 | 0.39 | 0.18 | 0.44 | 0.75 | 0.53 | 0.56 | 0.74 | 0.44 | 0.73 | 0.52 | 1.26 | 1.01 | 0.78 | 1.22 | 1.57 | 2.23 | 1.15 | 1.27 | 2.63 | 1.98 | 3.45 | 2.58 | 0.89 | 0.55 | 0.92 | 1.07 | 1.61 | 1.01 | 1.54 | 1.04 | 1.73 | 1.35 | 1.75 | 2.50 | 0.29 | 0.58 | 0.37 | 0.25 | 0.39 | 0.44 | 0.52 | 0.49 | 0.31 | 0.94 | 1.01 | 0.56 | 1.73 | 1.70 | 1.67 | 1.70 | 1.35 |
| 11-O-Demethylpradinone I | ME917799 | NA | 0.22 | NA | 0.21 | 0.87 | 1.19 | 1.18 | 0.82 | 0.77 | 0.36 | 0.52 | 0.51 | 1.82 | 1.85 | 1.86 | 1.79 | 1.52 | 1.49 | 1.79 | 1.53 | 0.58 | 1.16 | 0.81 | 0.70 | 1.57 | 1.07 | 1.72 | 1.19 | 0.86 | 1.20 | 1.17 | 1.02 | 0.70 | 0.61 | 0.53 | 0.58 | 0.91 | 0.97 | 1.01 | 0.69 | 0.69 | 0.86 | 0.89 | 1.01 | 0.33 | 0.80 | 0.52 | 0.35 | 1.15 | 1.46 | 1.31 | 1.26 | 1.00 |
| FA oxo(14:1) cyclopentanebutanoic acid | ME917807 | NA | 0.25 | NA | NA | 1.29 | 1.11 | 1.02 | 0.90 | 0.78 | 0.32 | 0.30 | 0.30 | 1.81 | 1.53 | 2.01 | 1.83 | 1.67 | 1.79 | 1.27 | 1.33 | 0.62 | 1.20 | 0.72 | 0.78 | 1.28 | 1.12 | 1.76 | 1.40 | 0.95 | 1.18 | 0.92 | 1.12 | 0.71 | 0.67 | 0.59 | 0.58 | 0.53 | 0.95 | 1.12 | 0.71 | 0.47 | 0.69 | 0.78 | 0.99 | NA | 0.84 | 0.31 | 0.35 | 1.27 | 1.34 | 1.31 | 1.34 | 0.93 |
| Imidazol-4-ylacetate | ME917730 | 0.89 | 0.14 | NA | NA | 0.54 | 1.04 | 0.61 | 0.66 | 0.90 | 0.54 | 1.20 | 0.50 | 1.37 | 0.89 | 1.17 | 1.76 | 1.58 | 0.95 | 1.55 | 1.70 | 1.14 | 0.56 | 1.35 | 1.48 | 1.98 | 0.97 | 1.69 | 1.74 | 1.07 | 0.67 | 1.32 | 0.75 | 1.21 | 0.71 | 0.47 | 1.25 | 0.78 | 1.29 | 0.75 | 0.52 | NA | 0.46 | 0.70 | 0.40 | NA | 0.41 | 0.34 | NA | 1.91 | 1.30 | 1.03 | 0.92 | 0.84 |
| [PI(16:0)] 1-hexadecanoyl-sn-glycero-3-phospho-(1^-myo-inositol) | ME917571 | 0.72 | 0.37 | 0.38 | NA | 0.83 | 0.77 | 0.58 | 0.87 | 0.72 | 0.58 | 0.86 | 0.66 | 2.29 | 1.56 | 1.63 | 1.75 | 1.36 | 1.24 | 1.90 | 1.62 | 1.07 | 0.86 | 0.98 | 1.37 | 1.56 | 1.15 | 1.91 | 1.80 | 0.75 | 0.71 | 1.00 | 1.10 | 0.91 | 0.71 | 0.51 | 0.76 | 0.56 | 1.08 | 0.99 | 0.86 | NA | 0.46 | 0.61 | 0.60 | 0.24 | 0.14 | 0.53 | 0.11 | 2.45 | 1.47 | 1.35 | 1.25 | 0.47 |
| N-Acetyl-D-mannosaminolactone | ME917937 | 0.55 | 0.51 | 0.58 | 0.16 | 0.29 | 0.27 | 0.33 | 0.27 | 0.25 | 0.17 | 0.23 | 0.13 | 0.80 | 0.88 | 0.95 | 1.24 | 2.02 | 2.03 | 1.16 | 1.37 | 1.31 | 0.87 | 1.40 | 0.92 | 1.77 | 1.81 | 2.38 | 1.79 | 1.85 | 1.70 | 1.95 | 2.07 | 1.11 | 0.64 | 0.74 | 1.08 | 0.21 | 0.30 | 0.30 | 0.14 | 0.93 | 1.47 | 1.80 | 1.66 | 0.22 | 0.85 | 0.40 | 0.46 | 1.15 | 1.36 | 1.46 | 1.43 | 1.30 |
| N-Acetyl-L-glutamate | ME917925 | 0.48 | 0.51 | 0.50 | 0.12 | 0.23 | 0.30 | 0.46 | 0.29 | 0.28 | 0.13 | 0.21 | 0.16 | 0.81 | 1.13 | 0.85 | 1.25 | 2.02 | 2.11 | 1.10 | 1.36 | 1.47 | 0.75 | 1.40 | 0.79 | 1.77 | 1.64 | 2.16 | 1.68 | 2.09 | 1.71 | 1.86 | 1.72 | 0.95 | 0.60 | 0.59 | 1.16 | 0.23 | 0.28 | 0.28 | 0.15 | 0.80 | 1.37 | 1.52 | 1.50 | 0.21 | 0.79 | 0.38 | 0.37 | 1.45 | 1.81 | 1.96 | 1.85 | 1.42 |
| 3,6-Dideoxy-L-galactose | ME917944 | 0.42 | 0.66 | 0.71 | 0.29 | 0.19 | 0.32 | 0.32 | 0.18 | 0.24 | 0.14 | 0.16 | 0.10 | 1.41 | 1.39 | 2.09 | 1.88 | 2.31 | 2.79 | 1.71 | 1.60 | 1.24 | 0.96 | 1.14 | 0.59 | 1.64 | 1.27 | 2.33 | 1.70 | 1.67 | 1.47 | 2.05 | 1.64 | 1.11 | 0.51 | 0.63 | 1.02 | 0.08 | 0.10 | 0.14 | 0.07 | 0.66 | 0.82 | 1.12 | 0.90 | 0.24 | 0.98 | 0.57 | 0.51 | 1.21 | 1.47 | 1.50 | 1.53 | 1.22 |
| [PG (18:1)] 1-(9E-octadecenoyl)-sn-glycero-3-phospho-(1^-sn-glycerol) | ME917901 | 0.46 | 0.49 | 0.53 | 0.25 | 0.12 | 0.22 | 0.40 | 0.12 | 0.27 | NA | 0.13 | NA | 1.16 | 1.43 | 1.74 | 1.62 | 1.89 | 2.41 | 1.47 | 1.24 | 1.32 | 0.87 | 1.03 | 0.52 | 1.37 | 1.16 | 1.90 | 1.44 | 1.51 | 1.35 | 1.67 | 1.35 | 0.99 | 0.51 | 0.53 | 0.94 | NA | NA | NA | NA | 0.50 | 0.64 | 0.85 | 0.76 | 0.24 | 0.84 | 0.50 | 0.46 | 1.22 | 1.72 | 1.83 | 1.84 | 1.21 |
| Azelaic acid | ME917757 | NA | NA | NA | NA | 0.38 | 0.99 | 0.33 | 0.90 | 0.80 | 0.63 | 0.71 | 0.53 | 1.23 | 1.15 | 0.80 | 0.87 | 1.61 | 1.54 | 2.67 | 1.25 | 1.16 | 1.70 | 1.28 | 0.99 | 0.79 | 0.67 | 0.63 | 1.01 | 0.88 | 1.11 | 1.14 | 1.80 | 1.06 | 1.14 | 0.95 | 1.06 | NA | 0.32 | 0.24 | 0.22 | 0.22 | 0.53 | 0.50 | 0.88 | 0.45 | 1.01 | 0.51 | 0.70 | 4.20 | 1.47 | 1.58 | 1.54 | 0.75 |
| N-Succinyl-L-glutamate | ME917878 | 0.57 | 0.28 | 0.45 | NA | 0.75 | 0.81 | 0.46 | 0.67 | 0.77 | 0.29 | 0.94 | 0.32 | 0.93 | 1.21 | 0.85 | 1.12 | 1.51 | 0.97 | 2.32 | 1.64 | 1.57 | 1.34 | 1.87 | 1.51 | 1.01 | 0.74 | 1.19 | 0.90 | 1.11 | 1.32 | 1.57 | 1.93 | 1.50 | 1.08 | 1.46 | 1.25 | 0.50 | 0.60 | 0.19 | NA | 0.24 | 0.40 | 0.49 | 0.57 | 1.04 | 0.83 | 0.87 | 0.47 | 2.82 | 1.01 | 1.01 | 0.89 | 0.84 |
| Hypoxanthine | ME917971 | 0.49 | 0.31 | 0.37 | 0.17 | 0.57 | 0.62 | 0.44 | 0.47 | 0.67 | 0.45 | 0.75 | 0.45 | 0.84 | 0.64 | 1.06 | 1.33 | 1.68 | 1.55 | 1.16 | 2.06 | 1.49 | 1.48 | 1.85 | 1.77 | 1.03 | 0.85 | 1.30 | 1.24 | 1.36 | 1.08 | 1.89 | 1.67 | 1.45 | 0.93 | 1.32 | 1.40 | 0.29 | 0.53 | 0.38 | 0.20 | 0.29 | 0.48 | 0.60 | 0.67 | 0.29 | 0.82 | 0.70 | 0.46 | 3.20 | 1.79 | 1.94 | 1.95 | 1.22 |
| N2-Succinyl-L-arginine | ME917996 | 0.41 | 0.27 | 0.27 | 0.15 | 0.54 | 0.72 | 0.57 | 0.54 | 0.69 | 0.56 | 0.70 | 0.47 | 0.99 | 0.84 | 1.13 | 1.46 | 1.52 | 1.72 | 1.56 | 1.84 | 1.57 | 1.84 | 1.65 | 1.68 | 0.92 | 0.75 | 1.37 | 0.99 | 1.22 | 1.47 | 1.80 | 1.82 | 1.26 | 0.87 | 1.28 | 1.23 | 0.28 | 0.57 | 0.38 | 0.32 | 0.30 | 0.40 | 0.27 | 0.46 | 0.26 | 0.73 | 0.68 | 0.50 | 3.01 | 1.63 | 1.81 | 1.84 | 0.92 |
| PE(34:1) | ME917993 | 0.41 | 0.27 | 0.27 | 0.15 | 0.54 | 0.72 | 0.57 | 0.54 | 0.69 | 0.56 | 0.70 | 0.47 | 0.99 | 0.84 | 1.14 | 1.46 | 1.52 | 1.72 | 1.56 | 1.84 | 1.57 | 1.84 | 1.65 | 1.68 | 0.92 | 0.75 | 1.37 | 0.99 | 1.22 | 1.47 | 1.80 | 1.82 | 1.26 | 0.87 | 1.28 | 1.23 | 0.28 | 0.57 | 0.38 | 0.32 | 0.26 | 0.40 | 0.55 | 0.58 | 0.29 | 0.73 | 0.69 | 0.50 | 3.02 | 1.63 | 1.81 | 1.84 | 0.51 |
| Glu-Thr | ME917907 | 0.49 | 0.28 | 0.29 | 0.25 | 0.49 | 0.82 | 0.35 | 0.54 | 0.66 | 0.44 | 0.66 | 0.36 | 1.08 | 0.85 | 1.01 | 1.17 | 1.91 | 1.48 | 2.00 | 1.86 | 1.51 | 1.53 | 1.78 | 1.77 | 1.04 | 0.81 | 1.23 | 1.19 | 1.44 | 1.20 | 1.76 | 1.51 | 1.66 | 0.97 | 1.17 | 1.37 | 0.29 | 0.54 | 0.33 | 0.21 | 0.32 | 0.44 | 0.56 | 0.80 | 0.48 | 0.74 | 0.57 | 0.44 | 3.47 | 1.60 | 1.50 | 1.55 | 1.23 |
| Pro-Arg | ME917967 | 0.42 | 0.31 | 0.26 | 0.20 | 0.55 | 0.74 | 0.42 | 0.57 | 0.70 | 0.47 | 0.65 | 0.45 | 0.89 | 1.04 | 1.02 | 1.31 | 1.62 | 1.62 | 2.04 | 1.68 | 1.42 | 1.50 | 1.70 | 1.60 | 1.16 | 0.57 | 0.98 | 1.29 | 1.11 | 1.29 | 1.77 | 0.88 | 1.22 | 0.90 | 1.18 | 1.33 | 0.30 | 0.50 | 0.39 | 0.22 | 0.35 | 0.50 | 0.58 | 0.57 | 0.42 | 0.67 | 0.68 | 0.44 | 3.82 | 1.87 | 1.83 | 1.96 | 1.08 |
| FA hydroxy(18:1) | ME917942 | 0.50 | 0.38 | 0.36 | 0.34 | 0.56 | 0.84 | 0.39 | 0.58 | 0.64 | 0.58 | 0.75 | 0.45 | 1.32 | 1.04 | 0.86 | 1.29 | 1.45 | 1.04 | 1.38 | 1.54 | 0.74 | 1.05 | 1.33 | 1.49 | 1.56 | 1.22 | 1.95 | 1.78 | 0.97 | 1.05 | 1.18 | 1.71 | 1.08 | 0.86 | 0.88 | 0.96 | 0.41 | 0.64 | 0.66 | 0.34 | 0.46 | 0.74 | 1.12 | 1.09 | 0.21 | 0.52 | 0.75 | 0.57 | 2.74 | 1.63 | 1.73 | 1.95 | 1.32 |
| Phenylpyruvate | ME917866 | 1.03 | 0.57 | 0.65 | 0.87 | 0.83 | 1.06 | 0.79 | 0.58 | 0.88 | 0.96 | 0.80 | 0.84 | 1.04 | 1.01 | 0.84 | 0.75 | 1.57 | 1.09 | 1.68 | 1.53 | 1.32 | 1.11 | 1.37 | 1.67 | 0.66 | 1.03 | 1.08 | 1.02 | 1.13 | 1.03 | 1.14 | 1.17 | 0.97 | 1.04 | 0.82 | 1.33 | 0.62 | 0.99 | 0.64 | 0.53 | 0.79 | 0.82 | 0.84 | 0.65 | 0.67 | 0.93 | 0.78 | 0.77 | 2.62 | 1.47 | 1.73 | 1.29 | 1.30 |
| 3-Methylbutanoic acid | ME917935 | 0.40 | NA | NA | NA | NA | 0.53 | 0.38 | 0.22 | 0.34 | 0.28 | 0.52 | 0.32 | 1.54 | 1.02 | 0.62 | 0.72 | 2.00 | 1.10 | 2.31 | 2.04 | 1.05 | 0.75 | 1.31 | 1.84 | 0.85 | 0.76 | 0.76 | 1.08 | 1.48 | 1.26 | 1.09 | 0.79 | 1.45 | 0.55 | 0.92 | 1.17 | NA | 0.50 | 0.47 | 0.30 | NA | 0.48 | 0.64 | 1.07 | NA | 0.58 | 0.46 | NA | 3.57 | 0.68 | 1.60 | 1.98 | 1.25 |
| Ile-Ala | ME917909 | 0.30 | 0.11 | 0.22 | 0.33 | 0.29 | 0.83 | 0.60 | 0.53 | 0.29 | 0.28 | 0.53 | 0.28 | 1.82 | 1.59 | 1.61 | 1.82 | 2.36 | 1.27 | 2.61 | 2.18 | 1.68 | 1.40 | 1.37 | 1.47 | 1.35 | 0.80 | 1.85 | 1.85 | 1.44 | 1.10 | 1.61 | 1.20 | 1.06 | 0.52 | 1.11 | 0.99 | 0.22 | 0.32 | 0.35 | 0.36 | 0.26 | 0.38 | 0.80 | 1.17 | 0.24 | 0.52 | 0.36 | 0.42 | 4.35 | 1.28 | 1.31 | 1.45 | 1.51 |
| alpha-Irone | ME917741 | 0.56 | 0.75 | 0.44 | 0.63 | 0.50 | 0.94 | NA | 1.03 | 0.76 | 0.41 | 0.72 | 0.28 | 1.47 | 1.19 | 0.46 | 0.58 | 2.01 | 1.12 | 1.21 | 1.27 | 1.34 | 1.46 | 1.69 | 2.01 | 1.02 | 0.99 | 0.65 | 1.01 | 1.80 | 0.92 | 1.48 | 1.04 | 1.70 | 1.01 | 1.14 | 1.46 | NA | 0.58 | 0.30 | NA | NA | 0.64 | 0.34 | 1.10 | NA | 0.91 | 0.93 | NA | 0.81 | 0.91 | 1.11 | 1.47 | 0.87 |
| (S)-ATPA | ME917861 | 0.94 | 0.60 | 0.81 | 0.26 | NA | 0.85 | NA | 0.70 | 0.95 | 0.61 | 0.90 | 0.51 | 0.69 | 0.88 | 0.96 | 0.76 | 1.29 | 1.18 | 1.22 | 1.79 | 2.43 | 1.60 | 1.48 | 1.64 | 0.89 | 0.76 | 0.68 | 0.98 | 1.75 | 0.93 | 1.51 | 1.59 | 1.52 | 1.37 | 1.32 | 1.29 | NA | 0.88 | 0.24 | NA | NA | NA | 0.64 | 0.97 | NA | 0.72 | 0.60 | 0.61 | 0.89 | 0.44 | 0.84 | 0.73 | 0.81 |
| 3-Ethylmalate | ME917643 | 0.81 | 0.51 | 0.68 | 0.45 | 0.59 | 0.75 | 0.68 | 0.59 | 0.77 | 0.55 | 0.59 | 0.61 | 1.24 | 1.06 | 0.88 | 0.81 | 1.19 | 2.11 | 1.03 | 1.21 | 1.91 | 1.23 | 1.91 | 1.62 | 1.26 | 0.72 | 0.97 | 0.85 | 1.41 | 1.24 | 2.04 | 0.95 | 1.25 | 0.71 | 0.87 | 1.46 | 0.37 | 0.57 | 0.49 | 0.53 | 0.62 | 0.67 | 1.07 | 2.57 | 0.52 | 0.93 | 1.09 | 0.64 | 1.65 | 1.95 | 1.86 | 1.98 | 1.37 |
| Arecoline | ME917647 | 0.79 | 0.60 | 0.72 | 0.46 | 0.57 | 0.69 | 0.75 | 0.57 | 0.75 | 0.56 | 0.58 | 0.63 | 1.15 | 1.12 | 0.85 | 0.75 | 1.16 | 1.80 | 1.01 | 1.06 | 1.88 | 1.57 | 2.11 | 1.58 | 1.23 | 0.72 | 0.94 | 0.86 | 1.37 | 1.21 | 1.99 | 0.93 | 1.22 | 0.70 | 0.88 | 1.42 | 0.38 | 0.55 | 0.51 | 0.52 | 0.61 | 0.65 | 1.04 | 2.51 | 0.50 | 0.91 | 1.06 | 0.68 | 1.75 | 2.23 | 1.89 | 2.05 | 1.33 |
| [FA trimethyl(13:2)] tridecadienoic acid | ME917917 | 0.43 | 0.74 | 0.50 | 0.32 | 0.60 | 0.92 | 0.67 | 0.78 | 0.77 | 0.73 | 0.80 | 0.61 | 0.87 | 1.10 | 1.15 | 1.05 | 0.88 | 1.40 | 1.58 | 1.40 | 1.47 | 2.56 | 1.71 | 1.72 | 0.60 | 0.88 | 1.01 | 1.02 | 1.13 | 1.34 | 2.13 | 1.74 | 1.17 | 1.05 | 1.61 | 1.15 | 0.42 | 0.53 | 0.67 | 0.52 | 0.50 | 0.50 | 0.41 | 1.18 | 0.60 | 0.62 | 1.26 | 0.35 | 2.94 | 0.89 | 0.97 | 1.04 | 1.00 |
| Leu-Pro-Pro | ME917980 | 0.52 | 0.67 | 0.47 | 0.74 | 0.55 | 0.88 | 0.62 | 0.83 | 0.85 | 0.73 | 0.70 | 0.47 | 1.30 | 1.48 | 1.20 | 0.91 | 0.91 | 1.17 | 1.92 | 1.42 | 1.45 | 2.30 | 1.98 | 1.75 | 0.71 | 0.86 | 0.98 | 0.80 | 1.30 | 1.30 | 1.91 | 1.55 | 1.34 | 1.12 | 1.48 | 1.18 | 0.53 | 0.53 | 0.63 | 0.62 | 0.36 | 0.30 | 0.44 | 1.18 | 1.20 | 0.68 | 1.10 | 0.45 | 1.11 | 1.03 | 1.04 | 1.18 | 1.24 |
| Gln-Phe-Pro-Pro | ME917946 | 0.30 | 0.14 | 0.32 | 0.10 | 0.56 | 0.97 | 0.68 | 0.54 | 0.74 | 0.50 | 0.59 | 0.32 | 1.28 | 1.47 | 1.76 | 1.27 | 2.74 | 2.75 | 1.56 | 1.97 | 3.00 | 1.93 | 2.18 | 1.59 | 1.31 | 1.04 | 1.45 | 1.04 | 1.25 | 1.35 | 1.60 | 0.91 | 1.31 | 0.85 | 0.99 | 0.93 | 0.36 | 0.50 | 0.38 | 0.27 | 0.30 | 0.34 | 0.41 | 0.28 | 0.31 | 0.91 | 0.73 | 0.42 | 0.91 | 0.92 | 1.36 | 1.20 | 1.13 |
| Glu-Ile-Ser | ME917611 | 0.35 | 0.26 | NA | 0.33 | 0.41 | 0.37 | 0.33 | 0.39 | 0.35 | 0.39 | 0.46 | 0.36 | 1.02 | 0.95 | 1.59 | 1.79 | 2.15 | 2.20 | 2.06 | 2.05 | 2.37 | 2.28 | 1.53 | 1.60 | 1.06 | 0.94 | 1.69 | 1.40 | 1.10 | 1.08 | 1.84 | 1.33 | 1.12 | 0.37 | 1.24 | 1.05 | 0.35 | 0.29 | 0.67 | 0.32 | NA | 0.65 | 0.47 | 0.72 | NA | 1.05 | 0.74 | 0.93 | 1.17 | 0.81 | 0.95 | 0.84 | 1.13 |
| Orthophosphate | ME917539 | 0.08 | 0.07 | 0.15 | NA | 0.35 | 0.65 | 0.82 | 0.36 | 0.44 | 0.21 | 0.33 | 0.18 | 1.33 | 2.32 | 1.53 | 1.11 | 1.66 | 2.91 | 1.41 | 1.53 | 2.77 | 1.05 | 2.15 | 1.31 | 1.27 | 0.97 | 1.56 | 1.34 | 1.86 | 1.28 | 1.90 | 1.15 | 0.70 | 0.50 | 0.63 | 1.08 | 0.21 | 0.21 | 0.26 | 0.20 | 0.31 | 0.34 | 0.51 | 0.36 | 0.16 | 0.48 | 0.33 | 0.26 | 1.55 | 2.17 | 1.97 | 1.92 | 1.78 |
| UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate | ME917535 | 0.09 | 0.08 | 0.15 | NA | 0.36 | 0.68 | 0.86 | 0.37 | 0.46 | 0.22 | 0.34 | 0.19 | 1.10 | 1.81 | 1.18 | 1.12 | 1.73 | 3.03 | 1.47 | 1.59 | 2.88 | 1.09 | 2.24 | 1.36 | 1.33 | 0.88 | 1.24 | 1.07 | 1.94 | 1.33 | 1.98 | 1.20 | 0.73 | 0.52 | 0.65 | 1.13 | 0.22 | 0.22 | 0.28 | 0.21 | 0.32 | 0.36 | 0.53 | 0.38 | 0.16 | 0.50 | 0.34 | 0.27 | 1.62 | 2.26 | 2.09 | 2.00 | 1.85 |
| 10,11-dihydro-20-trihydroxy-leukotriene B4 | ME917943 | 0.44 | 0.16 | 0.56 | 0.12 | 0.48 | 0.96 | 1.02 | 0.54 | 0.68 | 0.34 | 0.51 | 0.21 | 1.78 | 2.04 | 1.81 | 1.55 | 2.36 | 3.10 | 1.96 | 1.89 | 2.79 | 1.25 | 2.09 | 1.39 | 1.52 | 1.01 | 1.56 | 1.08 | 0.99 | 0.96 | 1.59 | 0.96 | 0.85 | 0.53 | 0.61 | 0.76 | 0.27 | 0.44 | 0.38 | 0.19 | 0.24 | 0.30 | 0.35 | 0.18 | 0.18 | 0.41 | 0.37 | 0.17 | 1.24 | 1.45 | 1.57 | 1.50 | 1.34 |
| L-Phenylalanine | ME917964 | 0.34 | 0.16 | 0.35 | 0.11 | 0.54 | 1.03 | 1.04 | 0.57 | 0.74 | 0.39 | 0.52 | 0.26 | 1.43 | 1.92 | 1.26 | 1.30 | 2.12 | 2.84 | 1.40 | 1.44 | 2.54 | 1.36 | 1.73 | 1.23 | 1.50 | 1.05 | 1.28 | 1.03 | 1.31 | 1.41 | 1.93 | 1.10 | 0.82 | 0.68 | 0.73 | 1.06 | 0.30 | 0.44 | 0.39 | 0.28 | 0.33 | 0.30 | 0.36 | 0.24 | 0.25 | 0.60 | 0.50 | 0.32 | 1.34 | 1.83 | 1.91 | 1.64 | 1.44 |
| Ala-Pro | ME917962 | 0.17 | 0.14 | 0.20 | 0.08 | 0.28 | 0.39 | 0.27 | 0.26 | 0.33 | 0.24 | 0.36 | 0.19 | 2.32 | 1.71 | 2.08 | 2.14 | 2.10 | 2.36 | 1.98 | 1.62 | 1.27 | 1.42 | 1.42 | 1.08 | 1.51 | 1.15 | 1.85 | 1.43 | 1.34 | 1.07 | 1.53 | 1.31 | 0.80 | 0.47 | 0.72 | 0.81 | 0.18 | 0.25 | 0.26 | 0.16 | 0.42 | 0.70 | 0.79 | 0.82 | 0.25 | 0.54 | 0.50 | 0.31 | 1.26 | 2.39 | 2.39 | 2.48 | 0.95 |
| Ophthalmicacid | ME917614 | 0.17 | 0.14 | 0.25 | 0.08 | 0.28 | 0.39 | 0.27 | 0.26 | 0.34 | 0.24 | 0.37 | 0.19 | 2.34 | 1.73 | 2.10 | 2.16 | 2.12 | 2.38 | 2.00 | 1.63 | 1.28 | 1.43 | 1.43 | 1.09 | 1.52 | 1.16 | 1.86 | 1.44 | 1.35 | 1.07 | 1.55 | 1.32 | 0.81 | 0.47 | 0.73 | 0.82 | 0.20 | 0.28 | 0.27 | 0.16 | 0.42 | 0.70 | 0.80 | 0.82 | 0.25 | 0.54 | 0.50 | 0.31 | 1.27 | 2.26 | 2.28 | 2.21 | 0.96 |
| 8,8-Dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b^]dipyran-4-one | ME918012 | 0.27 | 0.18 | 0.24 | 0.17 | 0.42 | 0.61 | 0.60 | 0.44 | 0.43 | 0.37 | 0.52 | 0.21 | 1.31 | 1.17 | 2.21 | 2.29 | 2.06 | 1.68 | 2.41 | 1.93 | 1.48 | 1.59 | 1.45 | 1.16 | 1.38 | 0.98 | 2.45 | 1.84 | 1.13 | 1.02 | 2.05 | 1.34 | 0.83 | 0.46 | 1.09 | 0.81 | 0.24 | 0.30 | 0.35 | 0.23 | 0.33 | 0.43 | 0.85 | 0.57 | 0.14 | 0.42 | 0.30 | 0.29 | 1.79 | 1.64 | 1.70 | 1.71 | 1.11 |
| Cys-Cys-Cys-Gly | ME917938 | 0.16 | 0.13 | 0.18 | 0.07 | 0.52 | 0.75 | 0.61 | 0.53 | 0.62 | 0.37 | 0.51 | 0.31 | 1.39 | 1.49 | 1.66 | 1.53 | 2.19 | 2.45 | 1.65 | 1.84 | 1.86 | 1.52 | 1.68 | 1.30 | 1.60 | 1.17 | 1.35 | 1.29 | 1.66 | 1.67 | 1.62 | 1.36 | 1.11 | 0.68 | 0.85 | 0.95 | 0.28 | 0.37 | 0.34 | 0.23 | 0.44 | 0.55 | 0.68 | 0.61 | 0.28 | 0.86 | 0.46 | 0.33 | 1.18 | 1.57 | 1.53 | 1.49 | 1.11 |
| 3-sulfopropanoate | ME917582 | 0.25 | 0.16 | 0.29 | 0.13 | 0.42 | 0.59 | 0.52 | 0.49 | 0.50 | 0.30 | 0.51 | 0.30 | 1.58 | 1.43 | 1.92 | 1.65 | 2.25 | 1.81 | 1.96 | 1.91 | 2.05 | 1.59 | 1.87 | 1.49 | 1.55 | 1.12 | 1.88 | 1.43 | 1.49 | 1.19 | 1.63 | 1.46 | 0.99 | 0.55 | 0.87 | 0.86 | 0.31 | 0.45 | 0.44 | 0.28 | 0.48 | 0.57 | 0.87 | 0.58 | 0.29 | 0.52 | 0.52 | 0.43 | 1.12 | 1.42 | 1.42 | 1.30 | 1.03 |
| UTP | ME917902 | 0.37 | 0.26 | 0.37 | 0.18 | 0.37 | 0.49 | 0.44 | 0.37 | 0.44 | 0.29 | 0.42 | 0.20 | 1.29 | 1.29 | 1.90 | 1.97 | 2.12 | 2.55 | 2.06 | 1.89 | 1.89 | 1.73 | 1.74 | 1.38 | 1.53 | 1.21 | 1.96 | 1.38 | 1.47 | 1.39 | 1.99 | 1.65 | 1.01 | 0.63 | 1.02 | 0.85 | 0.18 | 0.25 | 0.29 | 0.18 | 0.45 | 0.70 | 0.87 | 0.78 | 0.29 | 0.67 | 0.52 | 0.40 | 0.96 | 1.13 | 1.08 | 1.14 | 1.01 |
| Pantothenate | ME917947 | 0.70 | 0.35 | 0.84 | 0.28 | 0.36 | 0.68 | 0.62 | 0.45 | 0.53 | 0.32 | 0.50 | 0.25 | 1.83 | 1.78 | 2.15 | 1.99 | 1.89 | 2.41 | 2.09 | 1.80 | 2.02 | 1.12 | 1.83 | 1.24 | 1.52 | 1.13 | 1.69 | 1.37 | 0.94 | 0.87 | 1.29 | 0.95 | 0.66 | 0.50 | 0.65 | 0.68 | 0.28 | 0.43 | 0.40 | 0.27 | 0.35 | 0.49 | 0.59 | 0.39 | 0.18 | 0.45 | 0.41 | 0.24 | 1.33 | 1.92 | 1.93 | 1.81 | 1.25 |
| Carphenazine | ME917573 | 0.50 | 0.28 | 0.57 | 0.22 | 0.35 | 0.52 | 0.40 | 0.33 | 0.53 | 0.33 | 0.44 | 0.23 | 1.71 | 1.42 | 1.77 | 1.57 | 1.85 | 2.29 | 2.14 | 1.66 | 2.14 | 1.78 | 2.22 | 1.51 | 1.43 | 0.95 | 1.38 | 1.12 | 1.13 | 1.04 | 1.67 | 1.38 | 0.83 | 0.48 | 0.70 | 0.93 | 0.16 | 0.24 | 0.22 | 0.13 | 0.39 | 0.56 | 0.74 | 0.56 | 0.26 | 0.77 | 0.53 | 0.32 | 1.25 | 1.96 | 2.02 | 2.03 | 1.08 |
| S-Adenosyl-L-methionine | ME917577 | 0.48 | 0.28 | 0.58 | 0.23 | 0.34 | 0.49 | 0.38 | 0.32 | 0.49 | 0.33 | 0.44 | 0.24 | 1.75 | 1.47 | 1.76 | 1.56 | 1.91 | 2.27 | 2.12 | 1.68 | 2.19 | 1.83 | 2.18 | 1.59 | 1.45 | 0.94 | 1.35 | 1.10 | 1.13 | 1.02 | 1.65 | 1.33 | 0.86 | 0.49 | 0.73 | 0.99 | 0.16 | 0.23 | 0.22 | 0.13 | 0.39 | 0.56 | 0.76 | 0.61 | 0.26 | 0.80 | 0.53 | 0.33 | 1.27 | 1.92 | 1.91 | 1.96 | 1.04 |
| meta-O-Dealkylated flecainide lactam | ME917561 | NA | NA | NA | NA | NA | 0.87 | 0.27 | 0.65 | 0.31 | NA | 0.55 | 0.32 | 0.76 | 0.72 | 1.12 | 1.14 | 1.20 | 1.07 | 2.27 | 1.59 | 1.03 | 1.10 | 1.63 | 1.77 | 0.81 | 0.68 | 1.29 | 1.04 | 1.22 | 1.34 | 1.55 | 0.80 | 1.27 | 0.66 | 1.61 | 1.32 | NA | NA | 0.30 | NA | NA | NA | 0.30 | 1.04 | NA | 0.62 | 0.54 | 0.31 | NA | 1.81 | 0.96 | 1.01 | 1.15 |
| 5-Dehydro-4-deoxy-D-glucarate | ME917599 | NA | NA | NA | 0.27 | NA | 0.56 | NA | 0.53 | NA | 0.46 | 0.41 | NA | 0.94 | 0.67 | 0.96 | 1.19 | 1.50 | 1.81 | 1.80 | 1.46 | 0.99 | 1.33 | 1.27 | 1.33 | 1.21 | 0.61 | 1.07 | 1.37 | 0.69 | 1.24 | 1.74 | 1.11 | 1.13 | 0.56 | 0.62 | 1.13 | NA | NA | 0.31 | NA | NA | 0.46 | 0.41 | 0.50 | NA | NA | 0.48 | NA | 1.31 | 1.61 | 1.55 | 1.38 | 1.03 |
| Phenylalanyl-Tyrosine | ME917603 | NA | NA | NA | NA | 0.53 | 0.79 | 0.37 | 0.39 | 0.40 | NA | 0.77 | 0.28 | 1.03 | 0.98 | 1.13 | 1.25 | 1.46 | 1.87 | 1.78 | 1.74 | 1.07 | 1.09 | 1.39 | 1.43 | 1.23 | 0.49 | 1.49 | 1.20 | 1.32 | 1.57 | 2.06 | 1.71 | 1.09 | 0.37 | 0.87 | 1.07 | NA | 0.36 | 0.21 | NA | NA | 0.28 | 0.66 | 0.69 | NA | 0.35 | 0.30 | 0.36 | 1.04 | 1.53 | 1.54 | 1.58 | 0.88 |
| meso-Tartaric acid | ME917652 | NA | NA | NA | NA | 0.31 | 0.44 | 0.40 | 0.37 | 0.34 | 0.24 | 0.37 | 0.24 | 1.40 | 1.09 | 1.19 | 1.31 | 1.82 | 1.71 | 3.33 | 2.13 | 1.52 | 1.64 | 2.43 | 1.67 | 1.20 | 0.80 | 1.47 | 1.18 | 1.61 | 1.63 | 2.19 | 1.96 | 1.39 | 0.60 | 1.30 | 1.09 | 0.17 | 0.25 | 0.22 | 0.20 | 0.19 | 0.26 | 0.27 | 0.46 | 0.37 | 0.47 | 0.50 | 0.37 | 0.65 | 1.43 | 1.27 | 1.37 | 1.17 |
| L-beta-aspartyl-L-leucine | ME917957 | 0.97 | 0.52 | 1.10 | 0.43 | 0.31 | 0.42 | 0.34 | 0.29 | 0.41 | 0.23 | 0.34 | 0.16 | 1.03 | 0.79 | 1.86 | 1.37 | 1.63 | 2.23 | 2.82 | 1.95 | 1.93 | 1.26 | 2.17 | 1.63 | 1.20 | 0.74 | 1.30 | 1.29 | 1.44 | 1.24 | 2.50 | 1.97 | 0.81 | 0.48 | 0.77 | 1.29 | 0.08 | 0.11 | 0.10 | 0.06 | 0.38 | 0.44 | 0.76 | 0.43 | 0.28 | 0.89 | 0.52 | 0.33 | 1.24 | 1.61 | 1.67 | 1.73 | 1.14 |
| N-Undecylbenzenesulfonic acid | ME917585 | 0.99 | 0.52 | 1.14 | 0.41 | 0.32 | 0.39 | 0.38 | 0.31 | 0.42 | 0.23 | 0.38 | 0.17 | 1.07 | 0.70 | 1.74 | 1.28 | 1.64 | 2.10 | 2.63 | 1.91 | 1.91 | 1.27 | 2.18 | 1.60 | 1.24 | 0.70 | 1.29 | 1.36 | 1.46 | 1.19 | 2.38 | 2.02 | 0.87 | 0.55 | 0.87 | 1.42 | 0.09 | 0.12 | 0.12 | 0.06 | 0.37 | 0.47 | 0.74 | 0.49 | 0.27 | 0.93 | 0.53 | 0.36 | 1.20 | 1.67 | 1.61 | 1.73 | 1.21 |
| 2,4-diacetamido-2,4,6-trideoxy-β-L-altropyranose | ME917795 | NA | NA | NA | NA | 0.40 | 0.96 | 0.38 | 0.56 | 0.56 | 0.38 | 0.66 | 0.49 | 0.99 | 0.76 | 0.93 | 0.89 | 1.90 | 1.69 | 1.56 | 1.78 | 1.61 | 2.03 | 2.04 | 1.63 | 0.83 | 0.63 | 0.82 | 0.64 | 1.45 | 1.47 | 1.68 | 1.71 | 1.49 | 1.09 | 1.62 | 1.36 | 0.19 | 0.19 | 0.26 | 0.21 | 0.33 | 0.34 | 0.52 | 0.60 | 0.27 | 0.92 | 0.58 | 0.55 | 0.06 | 1.79 | 1.93 | 2.11 | 1.16 |
| Met-Val | ME917834 | 0.62 | 0.47 | 0.57 | 0.37 | 0.57 | 0.65 | 0.67 | 0.67 | 0.64 | 0.59 | 0.70 | 0.52 | 1.17 | 0.86 | 1.01 | 1.03 | 2.14 | 2.21 | 1.64 | 1.46 | 2.62 | 2.84 | 2.29 | 1.92 | 1.05 | 0.80 | 1.15 | 0.94 | 1.16 | 1.25 | 1.48 | 1.19 | 1.51 | 0.97 | 1.29 | 1.39 | 0.41 | 0.53 | 0.56 | 0.42 | 0.47 | 0.54 | 0.69 | 1.24 | 0.49 | 0.72 | 0.70 | 0.60 | 1.34 | 1.44 | 1.41 | 1.51 | 1.12 |
| N5-acetyl-N5-hydroxy-L-ornithine | ME917815 | 1.10 | 0.43 | 0.88 | 0.10 | 0.39 | 0.67 | 0.39 | 0.63 | 0.57 | 0.34 | 0.52 | 0.31 | 1.60 | 1.40 | 1.63 | 1.63 | 2.00 | 2.36 | 2.05 | 1.95 | 2.26 | 2.20 | 2.45 | 1.96 | 1.14 | 0.82 | 1.30 | 1.09 | 1.57 | 1.41 | 1.94 | 1.77 | 1.50 | 0.87 | 1.42 | 1.46 | 0.16 | 0.28 | 0.22 | 0.15 | 0.28 | 0.35 | 0.53 | 0.52 | 0.28 | 0.95 | 0.60 | 0.36 | 1.24 | 1.56 | 1.62 | 1.63 | 1.11 |
| Val-Val | ME917816 | 0.24 | 0.09 | 0.11 | NA | 0.39 | 0.77 | 0.46 | 0.49 | 0.70 | 0.39 | 0.59 | 0.34 | 1.24 | 1.21 | 1.26 | 1.47 | 1.52 | 2.06 | 1.52 | 1.70 | 2.16 | 1.58 | 2.22 | 1.89 | 1.16 | 0.86 | 1.47 | 1.39 | 1.95 | 1.22 | 1.96 | 1.54 | 1.25 | 0.76 | 1.20 | 1.54 | 0.20 | 0.42 | 0.26 | 0.19 | 0.29 | 0.25 | 0.36 | 0.38 | 0.22 | 0.67 | 0.57 | 0.35 | 1.28 | 1.46 | 1.43 | 1.48 | 1.51 |
| Arg-Ile-Ile-Trp | ME917827 | 0.11 | 0.08 | 0.11 | 0.04 | 0.47 | 0.61 | 0.49 | 0.45 | 0.73 | 0.46 | 0.76 | 0.48 | 1.37 | 1.08 | 1.27 | 1.42 | 1.65 | 1.90 | 1.76 | 1.68 | 2.34 | 2.12 | 2.40 | 1.96 | 0.86 | 0.60 | 1.11 | 0.92 | 1.45 | 1.34 | 1.89 | 1.58 | 1.70 | 0.93 | 1.57 | 1.40 | 0.20 | 0.34 | 0.23 | 0.16 | 0.24 | 0.36 | 0.50 | 0.41 | 0.35 | 0.73 | 0.53 | 0.44 | 1.26 | 1.56 | 1.83 | 1.65 | 1.08 |
| Formylpyruvate | ME917733 | 0.10 | 0.07 | 0.09 | 0.04 | 0.47 | 0.66 | 0.44 | 0.40 | 0.72 | 0.47 | 0.74 | 0.40 | 1.39 | 1.02 | 1.12 | 1.55 | 1.69 | 1.90 | 1.80 | 1.73 | 2.27 | 2.23 | 2.33 | 1.95 | 0.87 | 0.61 | 1.10 | 0.91 | 1.54 | 1.48 | 1.81 | 1.57 | 1.71 | 0.96 | 1.64 | 1.45 | 0.17 | 0.28 | 0.19 | 0.11 | 0.24 | 0.35 | 0.46 | 0.42 | 0.34 | 0.77 | 0.52 | 0.39 | 1.34 | 1.66 | 1.70 | 1.74 | 1.07 |
| Ile-Gly-Val | ME917651 | 0.43 | 0.33 | 0.42 | 0.15 | 0.50 | 0.70 | 0.36 | 0.46 | 0.83 | 0.52 | 0.67 | 0.40 | 1.27 | 0.96 | 1.16 | 1.22 | 1.63 | 1.94 | 2.21 | 1.57 | 1.87 | 2.03 | 2.28 | 1.69 | 0.95 | 0.61 | 0.98 | 0.74 | 1.17 | 1.03 | 1.90 | 1.60 | 1.39 | 0.91 | 1.18 | 1.27 | 0.19 | 0.34 | 0.25 | 0.16 | 0.24 | 0.34 | 0.40 | 0.40 | 0.38 | 0.96 | 0.76 | 0.53 | 1.25 | 2.21 | 2.12 | 2.15 | 1.01 |
| Oleoyl-CoA | ME917640 | 0.40 | 0.32 | 0.42 | 0.14 | 0.47 | 0.70 | 0.38 | 0.47 | 0.86 | 0.56 | 0.66 | 0.39 | 1.33 | 1.07 | 1.16 | 1.22 | 1.61 | 2.12 | 2.10 | 1.57 | 2.11 | 1.93 | 2.40 | 1.64 | 0.96 | 0.64 | 0.92 | 0.75 | 1.20 | 1.09 | 1.96 | 1.66 | 1.38 | 0.87 | 1.13 | 1.34 | 0.19 | 0.33 | 0.25 | 0.16 | 0.21 | 0.33 | 0.39 | 0.39 | 0.38 | 0.94 | 0.74 | 0.48 | 1.14 | 2.03 | 2.02 | 2.00 | 1.13 |
| Methyl 2-diazoacetamidohexonate | ME917779 | 0.38 | 0.29 | 0.29 | 0.17 | 0.66 | 0.85 | 0.64 | 0.67 | 0.79 | 0.63 | 0.75 | 0.53 | 1.19 | 1.12 | 1.24 | 1.50 | 2.02 | 2.09 | 2.14 | 2.06 | 2.18 | 1.93 | 2.17 | 2.05 | 1.03 | 0.85 | 1.24 | 1.14 | 1.52 | 1.57 | 2.06 | 1.81 | 1.64 | 1.12 | 1.64 | 1.54 | 0.35 | 0.57 | 0.40 | 0.27 | 0.31 | 0.40 | 0.51 | 0.66 | 0.58 | 0.91 | 0.78 | 0.55 | 1.15 | 0.96 | 0.94 | 1.02 | 1.12 |
| N-Undecanoylglycine | ME917756 | 0.08 | 0.05 | 0.05 | 0.04 | 0.40 | 0.96 | 0.45 | 0.66 | 0.67 | 0.44 | 0.74 | 0.42 | 1.34 | 1.07 | 0.80 | 0.85 | 2.35 | 2.03 | 2.59 | 2.31 | 1.87 | 2.31 | 1.86 | 1.82 | 0.91 | 0.70 | 0.76 | 0.76 | 1.82 | 1.30 | 1.50 | 1.80 | 1.86 | 1.08 | 1.80 | 1.39 | 0.24 | 0.35 | 0.25 | 0.26 | 0.22 | 0.33 | 0.37 | 0.69 | 0.66 | 0.80 | 0.55 | 0.55 | 1.42 | 1.40 | 1.40 | 1.47 | 1.19 |
| L-Tyrosine | ME917958 | 0.09 | 0.04 | 0.12 | 0.03 | 0.44 | 1.00 | 0.77 | 0.55 | 0.56 | 0.25 | 0.39 | 0.21 | 1.59 | 2.28 | 1.25 | 1.43 | 1.33 | 2.21 | 1.28 | 1.66 | 1.72 | 1.63 | 1.77 | 1.44 | 1.15 | 0.76 | 1.11 | 1.06 | 1.79 | 1.47 | 1.96 | 1.41 | 0.91 | 0.71 | 1.02 | 1.24 | 0.18 | 0.29 | 0.22 | 0.12 | 0.58 | 0.55 | 1.18 | 1.22 | 0.41 | 1.03 | 0.95 | 0.47 | 1.35 | 1.51 | 1.53 | 1.49 | 1.30 |
| LysoPA(16:0) | ME917596 | 0.08 | 0.04 | 0.13 | NA | 0.38 | 0.90 | 0.73 | 0.51 | 0.51 | 0.26 | 0.41 | 0.22 | 1.52 | 2.29 | 1.18 | 1.38 | 1.34 | 1.98 | 1.26 | 1.50 | 1.72 | 1.48 | 1.65 | 1.44 | 1.10 | 0.81 | 1.11 | 1.05 | 1.64 | 1.44 | 1.99 | 1.50 | 0.96 | 0.74 | 1.07 | 1.24 | 0.18 | 0.31 | 0.20 | 0.16 | 0.45 | 0.61 | 1.13 | 1.24 | 0.42 | 0.99 | 0.90 | 0.50 | 1.49 | 1.51 | 1.51 | 1.54 | 1.31 |
| Bendiocarb | ME917933 | 0.37 | 0.40 | 0.44 | 0.32 | 1.12 | 0.94 | 0.76 | 0.73 | 0.87 | 0.55 | 0.58 | 0.58 | 0.90 | 1.39 | 0.99 | 1.15 | 1.48 | 1.85 | 1.31 | 1.18 | 1.23 | 1.95 | 1.06 | 0.91 | 1.17 | 0.71 | 1.11 | 1.25 | 1.25 | 1.59 | 1.40 | 1.27 | 1.48 | 1.34 | 1.26 | 1.18 | 0.63 | 0.59 | 0.62 | 0.52 | 0.35 | 0.45 | 0.67 | 0.50 | 0.70 | 1.25 | 0.76 | 0.57 | 1.87 | 1.33 | 1.75 | 1.40 | 0.98 |
| Raffinose | ME917833 | 1.04 | 0.84 | 0.75 | 1.58 | 0.53 | 0.81 | 0.54 | 0.55 | 0.61 | 0.39 | 0.55 | 0.39 | 1.20 | 1.05 | 1.15 | 1.20 | 1.61 | 1.70 | 1.83 | 1.46 | 1.70 | 1.26 | 1.96 | 1.51 | 1.06 | 0.89 | 1.16 | 1.08 | 1.38 | 1.35 | 1.53 | 1.20 | 1.49 | 0.88 | 1.11 | 1.02 | 0.30 | 0.72 | 0.48 | 0.27 | 0.42 | 0.57 | 0.66 | 0.71 | 0.75 | 0.60 | 0.58 | 0.34 | 1.34 | 1.42 | 1.35 | 1.53 | 0.60 |
| LysoPE(18:1) | ME917896 | 0.61 | 0.36 | 0.44 | 0.25 | 0.58 | 0.70 | 0.48 | 0.55 | 0.73 | 0.51 | 0.89 | 0.47 | 0.85 | 0.60 | 0.75 | 1.00 | 1.48 | 1.22 | 1.58 | 1.53 | 1.30 | 0.81 | 2.06 | 1.65 | 1.60 | 1.00 | 1.48 | 1.76 | 1.86 | 1.16 | 1.63 | 1.52 | 1.55 | 0.76 | 1.19 | 1.50 | 0.29 | 0.61 | 0.36 | 0.27 | 0.42 | 0.64 | 0.81 | 0.84 | 0.29 | 0.60 | 0.67 | 0.73 | 1.45 | 1.82 | 1.62 | 1.83 | 1.34 |
| Allysine | ME917612 | 0.75 | 0.40 | 0.66 | 0.36 | 0.43 | 0.82 | 0.46 | 0.94 | 0.62 | 0.45 | 0.57 | 0.36 | 1.60 | 0.90 | 0.85 | 0.96 | 1.58 | 1.13 | 1.83 | 1.59 | 1.36 | 1.23 | 1.39 | 2.38 | 1.02 | 0.85 | 1.03 | 1.32 | 1.52 | 1.10 | 1.67 | 1.25 | 1.18 | 0.63 | 0.78 | 1.45 | 0.43 | 1.03 | 0.51 | 0.60 | 0.36 | 0.60 | 0.80 | 1.23 | 0.40 | 0.60 | 0.61 | 0.56 | 1.72 | 1.60 | 1.61 | 1.66 | 1.23 |
| Asp-Cys-Cys-Ser | ME917883 | 0.75 | 0.29 | 0.47 | 0.43 | 0.57 | 0.75 | 0.48 | 0.58 | 0.50 | 0.48 | 0.88 | 0.56 | 1.41 | 1.04 | 0.79 | 1.15 | 1.45 | 0.95 | 1.86 | 1.79 | 0.98 | 0.64 | 1.37 | 1.93 | 1.37 | 0.97 | 1.28 | 1.75 | 1.46 | 1.35 | 1.77 | 1.32 | 1.44 | 0.88 | 0.97 | 1.51 | 0.34 | 0.69 | 0.41 | 0.43 | 0.33 | 0.60 | 0.80 | 1.42 | 0.39 | 0.62 | 0.58 | 0.77 | 1.50 | 1.44 | 1.53 | 1.64 | 1.38 |
| 3-Deoxy-D-manno-octulosonate | ME917721 | 0.86 | 0.77 | 0.77 | 0.39 | 0.59 | 0.88 | 0.47 | 0.76 | 0.69 | 0.45 | 0.75 | 0.46 | 0.99 | 0.83 | 1.00 | 1.17 | 1.51 | 1.43 | 1.09 | 1.78 | 1.30 | 0.86 | 1.54 | 1.72 | 1.25 | 0.72 | 0.81 | 1.26 | 1.18 | 1.26 | 1.44 | 1.00 | 1.40 | 0.77 | 1.07 | 1.28 | 0.36 | 0.84 | 0.69 | 0.14 | 0.63 | 0.83 | 1.01 | 1.14 | 0.44 | 0.65 | 0.48 | 0.33 | 1.98 | 1.90 | 1.84 | 1.66 | 1.61 |
| 2-Dodecylbenzenesulfonic acid | ME917595 | 1.15 | 0.50 | 0.53 | 0.39 | 0.57 | 1.01 | 0.40 | 0.69 | 0.69 | 0.47 | 0.81 | 0.53 | 1.15 | 1.04 | 0.94 | 1.15 | 1.54 | 1.36 | 1.47 | 1.39 | 1.42 | 1.22 | 1.78 | 1.62 | 1.36 | 1.03 | 1.09 | 1.22 | 1.25 | 0.94 | 1.38 | 1.12 | 1.40 | 0.81 | 0.99 | 1.12 | 0.41 | 0.92 | 0.63 | 0.29 | 0.46 | 0.81 | 0.85 | 1.16 | 0.34 | 0.67 | 0.59 | 0.43 | 0.99 | 2.09 | 1.85 | 1.86 | 1.11 |
| [FA trimethyl(13:2)] 10,11-epoxy-3,7,11-trimethyl-2E,6E-tridecadienoic acid | ME917772 | 1.00 | 0.49 | 0.60 | 0.29 | 0.48 | 0.98 | 0.42 | 0.59 | 0.62 | 0.41 | 0.82 | 0.47 | 1.05 | 0.85 | 0.91 | 1.03 | 1.68 | 1.23 | 1.38 | 1.53 | 1.34 | 1.24 | 1.70 | 1.87 | 1.18 | 0.89 | 1.08 | 1.36 | 1.37 | 1.08 | 1.48 | 1.52 | 1.57 | 1.01 | 1.26 | 1.41 | 0.40 | 0.95 | 0.47 | 0.22 | 0.46 | 0.67 | 0.85 | 1.21 | 0.42 | 0.77 | 0.63 | 0.59 | 0.28 | 1.99 | 1.70 | 1.80 | 1.44 |
| Lys-Ser | ME917615 | 0.59 | 0.41 | 0.43 | 0.28 | 0.80 | 1.00 | 0.71 | 0.70 | 0.84 | 0.72 | 0.92 | 0.65 | 1.19 | 1.22 | 1.31 | 1.40 | 1.59 | 0.76 | 1.25 | 1.17 | 1.28 | 1.57 | 1.80 | 1.39 | 1.39 | 0.98 | 1.31 | 1.22 | 1.61 | 1.06 | 1.43 | 1.17 | 1.59 | 0.99 | 1.31 | 1.31 | 0.52 | 0.77 | 0.60 | 0.32 | 0.45 | 0.52 | 0.67 | 0.69 | 0.58 | 0.78 | 0.80 | 0.56 | 1.67 | 1.23 | 1.32 | 1.16 | 1.02 |
| 2-6-10-Trimethylundecanoicacid | ME917674 | 0.92 | 0.59 | 0.56 | 0.30 | 0.59 | 0.66 | 0.77 | 0.66 | 0.86 | 0.59 | 0.75 | 0.67 | 1.12 | 1.20 | 1.47 | 1.40 | 1.69 | 1.92 | 1.72 | 1.64 | 1.77 | 2.03 | 1.95 | 1.52 | 1.21 | 1.00 | 1.40 | 1.11 | 1.39 | 1.31 | 1.66 | 1.50 | 2.08 | 1.33 | 1.59 | 1.81 | 0.29 | 0.59 | 0.44 | 0.29 | 0.47 | 0.54 | 0.61 | 0.75 | 0.53 | 0.99 | 1.10 | 0.87 | 1.09 | 1.16 | 1.16 | 1.15 | 1.12 |
| Benzoate | ME917690 | 0.89 | 0.56 | 0.56 | 0.31 | 0.57 | 0.66 | 0.77 | 0.68 | 0.86 | 0.62 | 0.78 | 0.73 | 1.16 | 1.22 | 1.44 | 1.42 | 1.55 | 1.85 | 1.66 | 1.60 | 1.66 | 1.98 | 1.86 | 1.50 | 1.22 | 1.04 | 1.45 | 1.06 | 1.37 | 1.31 | 1.71 | 1.51 | 2.03 | 1.27 | 1.60 | 1.87 | 0.30 | 0.58 | 0.48 | 0.32 | 0.48 | 0.55 | 0.61 | 0.78 | 0.54 | 1.04 | 1.05 | 0.90 | 1.18 | 1.19 | 1.19 | 1.18 | 1.19 |
| Ala-Leu-Val-Ser | ME917812 | 0.88 | 0.36 | 0.35 | 0.19 | 0.44 | 0.81 | 0.65 | 0.55 | 1.09 | 0.37 | 1.05 | 0.46 | 1.13 | 0.86 | 1.28 | 1.08 | 1.67 | 1.56 | 1.54 | 1.71 | 1.63 | 1.71 | 1.96 | 1.56 | 0.87 | 0.81 | 1.05 | 1.04 | 1.15 | 1.33 | 1.64 | 1.64 | 1.55 | 1.11 | 1.38 | 1.29 | 0.25 | 0.71 | 0.53 | 0.22 | 0.38 | 0.73 | 0.34 | 1.02 | 0.52 | 1.26 | 0.71 | 0.63 | 1.25 | 1.37 | 1.13 | 1.16 | 1.03 |
| beta-Casomorphin (1-6) | ME917568 | 1.08 | 0.53 | 0.63 | 0.42 | 0.56 | 0.96 | 0.37 | 0.79 | 0.92 | 0.63 | 0.97 | 0.52 | 0.93 | 0.84 | 0.82 | 1.00 | 1.66 | 1.34 | 1.47 | 1.49 | 1.65 | 1.42 | 1.46 | 1.73 | 1.21 | 0.82 | 1.13 | 0.95 | 1.54 | 1.33 | 1.52 | 1.22 | 1.97 | 1.25 | 1.53 | 1.33 | 0.40 | 0.83 | 0.48 | 0.31 | 0.38 | 0.56 | 0.57 | 1.27 | 0.51 | 0.90 | 0.77 | 0.52 | 1.27 | 1.04 | 0.94 | 1.07 | 1.19 |
| Ala-Lys-Met-Trp | ME917850 | 0.39 | 0.33 | 0.34 | 0.21 | 0.82 | 0.91 | 0.49 | 0.61 | 0.83 | 0.36 | 0.82 | 0.58 | 1.39 | 1.01 | 1.47 | 1.55 | 1.80 | 1.71 | 1.94 | 1.84 | 1.53 | 0.63 | 1.31 | 1.30 | 1.64 | 1.32 | 1.15 | 1.46 | 1.55 | 1.28 | 2.00 | 1.66 | 1.24 | 0.70 | 1.08 | 1.10 | 0.34 | 0.66 | 0.59 | 0.31 | 0.34 | 0.62 | 0.73 | 0.88 | 0.31 | 1.09 | 0.83 | 0.55 | 1.23 | 1.26 | 1.39 | 1.14 | 1.19 |
| Phenylacetylglycine | ME917774 | 0.90 | 0.52 | 0.72 | 0.40 | 0.50 | 0.95 | 0.70 | 0.65 | 0.72 | 0.52 | 0.58 | 0.47 | 1.32 | 1.77 | 1.50 | 1.22 | 1.77 | 2.25 | 1.61 | 1.83 | 1.61 | 1.14 | 1.75 | 1.50 | 0.91 | 0.98 | 1.32 | 1.17 | 1.80 | 1.43 | 2.11 | 1.26 | 1.04 | 0.85 | 1.01 | 1.25 | 0.48 | 0.72 | 0.48 | 0.51 | 0.42 | 0.57 | 0.68 | 0.62 | 0.48 | 0.74 | 0.82 | 0.56 | 1.06 | 1.43 | 1.56 | 1.59 | 1.41 |
| PG(30:1) | ME917737 | 0.83 | 0.59 | 0.63 | 0.44 | 0.67 | 1.06 | 0.64 | 0.73 | 0.69 | 0.52 | 0.61 | 0.45 | 1.31 | 1.55 | 1.44 | 1.22 | 1.58 | 2.11 | 1.56 | 1.89 | 1.51 | 1.34 | 1.68 | 1.33 | 1.14 | 1.14 | 1.46 | 1.35 | 1.72 | 1.49 | 2.18 | 1.39 | 1.06 | 0.94 | 0.94 | 1.27 | 0.42 | 0.67 | 0.55 | 0.47 | 0.48 | 0.63 | 0.81 | 0.73 | 0.40 | 0.76 | 0.83 | 0.48 | 0.98 | 1.40 | 1.59 | 1.45 | 1.32 |
| Xanthosine 5^-phosphate | ME917588 | 0.82 | 0.45 | 0.59 | 0.36 | 0.57 | 1.07 | 0.53 | 0.66 | 0.60 | 0.54 | 0.63 | 0.46 | 1.36 | 1.46 | 1.68 | 1.32 | 1.61 | 2.17 | 1.61 | 1.93 | 1.50 | 1.24 | 1.86 | 1.39 | 1.25 | 1.04 | 1.43 | 1.46 | 1.69 | 1.62 | 2.28 | 1.42 | 1.16 | 0.88 | 1.00 | 1.12 | 0.38 | 0.63 | 0.39 | 0.80 | 0.43 | 0.59 | 0.75 | 0.78 | 0.35 | 0.88 | 0.76 | 0.48 | 1.01 | 1.41 | 1.70 | 1.40 | 1.18 |
| Deoxyribose | ME917602 | 0.39 | 0.43 | 0.28 | 0.26 | 0.72 | 0.71 | 0.74 | 0.54 | 0.80 | 0.62 | 0.60 | 0.51 | 1.67 | 1.34 | 1.39 | 1.63 | 1.23 | 2.16 | 1.98 | 1.58 | 1.31 | 1.73 | 1.53 | 1.20 | 1.16 | 0.98 | 1.61 | 1.18 | 1.08 | 1.39 | 1.76 | 1.71 | 1.13 | 0.79 | 1.03 | 1.00 | 0.33 | 0.45 | 0.45 | 0.34 | 0.39 | 0.54 | 0.59 | 0.98 | 0.54 | 0.67 | 0.73 | 0.34 | 1.20 | 1.37 | 1.41 | 1.46 | 1.04 |
| 1,6-anhydro-N-acetylmuramate | ME918018 | 0.23 | 0.18 | 0.24 | 0.14 | 0.81 | 0.76 | 0.72 | 0.84 | 0.69 | 0.50 | 0.73 | 0.46 | 1.45 | 1.15 | 1.45 | 1.58 | 1.54 | 1.58 | 1.90 | 1.56 | 1.71 | 1.60 | 1.66 | 1.37 | 1.19 | 0.82 | 1.50 | 1.14 | 1.53 | 1.51 | 1.94 | 1.59 | 1.39 | 0.78 | 1.25 | 1.32 | 0.36 | 0.50 | 0.52 | 0.41 | 0.51 | 0.66 | 0.79 | 0.74 | 0.32 | 0.60 | 0.50 | 0.37 | 1.04 | 1.27 | 1.41 | 1.26 | 0.96 |
| Indoleacrylicacid | ME918025 | 0.22 | 0.17 | 0.18 | 0.12 | 0.74 | 0.86 | 0.72 | 0.75 | 0.71 | 0.50 | 0.77 | 0.49 | 1.44 | 1.24 | 1.71 | 1.69 | 1.68 | 1.88 | 1.97 | 1.66 | 1.61 | 1.67 | 1.76 | 1.32 | 1.05 | 0.99 | 1.56 | 1.15 | 1.46 | 1.41 | 1.88 | 1.78 | 1.36 | 0.86 | 1.30 | 1.14 | 0.40 | 0.51 | 0.54 | 0.35 | 0.43 | 0.52 | 0.76 | 0.80 | 0.30 | 0.71 | 0.45 | 0.43 | 1.03 | 1.23 | 1.35 | 1.26 | 1.08 |
| D-Glyceraldehyde | ME917873 | 0.48 | 0.30 | 0.36 | 0.17 | 0.55 | 0.85 | 0.59 | 0.58 | 0.77 | 0.47 | 0.69 | 0.44 | 1.30 | 1.20 | 1.38 | 1.41 | 1.74 | 1.93 | 1.36 | 1.69 | 1.24 | 1.01 | 1.52 | 1.57 | 1.43 | 0.98 | 1.55 | 1.52 | 1.73 | 1.62 | 1.85 | 1.59 | 1.21 | 0.88 | 1.04 | 1.29 | 0.34 | 0.64 | 0.45 | 0.27 | 0.47 | 0.53 | 0.64 | 0.68 | 0.44 | 0.81 | 0.70 | 0.48 | 1.13 | 1.40 | 1.29 | 1.30 | 1.15 |
| Indolepyruvate | ME917862 | 0.85 | 0.35 | 0.50 | 0.14 | 0.67 | 0.74 | 0.57 | 0.84 | 0.81 | 0.55 | 0.81 | 0.43 | 1.29 | 1.21 | 1.27 | 1.31 | 1.74 | 2.00 | 1.83 | 1.76 | 1.45 | 1.73 | 1.63 | 1.56 | 1.42 | 0.95 | 1.31 | 0.95 | 1.50 | 1.45 | 1.89 | 1.50 | 1.21 | 1.03 | 1.19 | 1.27 | 0.25 | 0.57 | 0.48 | 0.19 | 0.50 | 0.51 | 0.65 | 0.74 | 0.63 | 0.91 | 0.71 | 0.47 | 1.27 | 1.14 | 1.04 | 1.10 | 1.08 |
| 5-Methylcytidine | ME917922 | 0.51 | 0.39 | 0.46 | 0.31 | 0.41 | 0.84 | 0.68 | 0.78 | 0.63 | 0.64 | 0.76 | 0.62 | 1.57 | 1.40 | 1.54 | 1.74 | 1.97 | 2.10 | 1.94 | 1.76 | 1.61 | 1.38 | 1.42 | 1.39 | 1.54 | 1.16 | 1.52 | 1.34 | 1.36 | 1.24 | 1.84 | 1.66 | 1.14 | 0.82 | 0.95 | 0.97 | 0.39 | 0.52 | 0.69 | 0.36 | 0.45 | 0.62 | 0.71 | 0.73 | 0.41 | 0.83 | 0.85 | 0.44 | 1.26 | 1.08 | 1.02 | 1.05 | 1.09 |
| penem CGP31608 | ME917796 | 0.84 | 0.44 | 0.43 | 0.19 | 0.69 | 0.95 | 0.62 | 0.73 | 0.73 | 0.50 | 0.72 | 0.54 | 1.46 | 1.33 | 1.64 | 1.81 | 1.71 | 1.88 | 1.78 | 1.72 | 1.50 | 1.27 | 1.45 | 1.25 | 1.53 | 1.23 | 1.48 | 1.42 | 1.37 | 1.40 | 1.70 | 1.58 | 1.11 | 0.71 | 1.02 | 0.94 | 0.24 | 0.63 | 0.48 | 0.38 | 0.41 | 0.58 | 0.69 | 0.63 | 0.58 | 0.78 | 0.60 | 0.51 | 1.14 | 1.07 | 1.21 | 1.17 | 1.14 |
| Formylfusarochromanone | ME917959 | 0.29 | 0.22 | 0.34 | 0.12 | 0.67 | 1.03 | 0.68 | 0.62 | 0.77 | 0.51 | 0.61 | 0.41 | 1.25 | 1.33 | 1.38 | 1.24 | 1.85 | 2.22 | 1.32 | 1.53 | 2.05 | 1.62 | 1.76 | 1.37 | 1.30 | 0.93 | 1.25 | 0.96 | 1.32 | 1.51 | 1.75 | 1.21 | 1.27 | 0.97 | 1.14 | 1.07 | 0.34 | 0.45 | 0.41 | 0.28 | 0.41 | 0.39 | 0.52 | 0.42 | 0.37 | 0.93 | 0.66 | 0.51 | 1.11 | 1.80 | 1.76 | 1.68 | 1.11 |
| Glu-Ser-Trp | ME917559 | 0.33 | 0.36 | 0.36 | 0.21 | 0.73 | 0.90 | 0.78 | 0.74 | 0.74 | 0.61 | 0.70 | 0.47 | 1.26 | 1.30 | 1.41 | 1.42 | 1.77 | 1.89 | 1.37 | 1.49 | 1.70 | 1.54 | 1.51 | 1.29 | 1.36 | 1.07 | 1.26 | 1.08 | 1.28 | 1.60 | 1.62 | 1.28 | 1.29 | 1.02 | 1.15 | 1.18 | 0.48 | 0.56 | 0.58 | 0.39 | 0.49 | 0.54 | 0.72 | 0.58 | 0.38 | 0.86 | 0.66 | 0.54 | 1.09 | 1.32 | 1.37 | 1.33 | 1.03 |
| N-Acetylornithine | ME917809 | 0.35 | 0.26 | 0.25 | NA | 0.38 | 0.83 | 0.62 | 0.63 | 0.80 | 0.54 | 0.73 | 0.45 | 1.16 | 0.86 | 1.28 | 1.11 | 1.48 | 2.04 | 1.71 | 1.60 | 1.70 | 1.90 | 1.47 | 1.64 | 1.09 | 0.97 | 1.37 | 1.25 | 1.39 | 1.25 | 1.84 | 1.33 | 1.34 | 1.16 | 1.26 | 1.60 | 0.31 | 0.59 | 0.49 | 0.25 | 0.31 | 0.54 | 0.83 | 0.84 | 0.27 | 0.86 | 0.79 | 0.51 | 0.66 | 1.34 | 1.33 | 1.29 | 1.14 |
| 2-Deoxy-D-ribose 5-phosphate | ME917700 | 0.60 | 0.44 | 0.43 | 0.25 | 0.58 | 0.94 | 0.56 | 0.60 | 0.81 | 0.66 | 0.81 | 0.56 | 1.08 | 0.93 | 0.96 | 1.16 | 1.66 | 1.73 | 1.92 | 1.71 | 1.71 | 1.74 | 1.82 | 1.69 | 0.97 | 0.73 | 0.95 | 0.90 | 1.57 | 1.35 | 1.92 | 1.50 | 1.54 | 1.06 | 1.41 | 1.39 | 0.44 | 0.69 | 0.42 | 0.35 | 0.36 | 0.46 | 0.50 | 0.58 | 0.62 | 0.81 | 0.78 | 0.50 | 0.84 | 1.30 | 1.35 | 1.31 | 1.05 |
| Glu-Pro-Ser | ME918005 | 0.53 | 0.41 | 0.39 | 0.35 | 0.56 | 0.89 | 0.46 | 0.61 | 0.60 | 0.59 | 0.69 | 0.43 | 1.11 | 0.97 | 1.19 | 1.19 | 1.67 | 1.53 | 2.04 | 1.63 | 1.72 | 1.54 | 1.66 | 1.54 | 1.16 | 0.86 | 1.09 | 1.39 | 1.52 | 1.31 | 1.56 | 1.42 | 1.42 | 0.95 | 1.26 | 1.21 | 0.46 | 0.76 | 0.51 | 0.26 | 0.38 | 0.53 | 0.64 | 1.08 | 0.55 | 0.92 | 0.66 | 0.52 | 0.88 | 1.37 | 1.51 | 1.35 | 1.16 |
| FA(16:1) | ME917601 | 0.47 | 0.29 | 0.31 | 0.20 | 0.58 | 0.85 | 0.50 | 0.58 | 0.75 | 0.57 | 0.69 | 0.47 | 1.17 | 1.04 | 1.22 | 1.37 | 1.54 | 1.94 | 1.90 | 1.64 | 1.68 | 1.73 | 1.72 | 1.60 | 1.18 | 0.89 | 1.33 | 1.08 | 1.26 | 1.45 | 1.94 | 1.68 | 1.30 | 1.04 | 1.15 | 1.27 | 0.33 | 0.53 | 0.40 | 0.26 | 0.33 | 0.43 | 0.61 | 0.63 | 0.39 | 0.80 | 0.73 | 0.43 | 0.67 | 1.75 | 1.71 | 1.62 | 1.00 |
| Val-Gly-Pro | ME917660 | 0.52 | 0.36 | 0.34 | 0.29 | 0.58 | 0.80 | 0.63 | 0.59 | 0.73 | 0.52 | 0.71 | 0.50 | 1.34 | 1.18 | 1.29 | 1.40 | 1.90 | 1.88 | 1.83 | 1.77 | 1.81 | 1.84 | 1.93 | 1.79 | 1.27 | 1.00 | 1.47 | 1.22 | 1.52 | 1.49 | 1.98 | 1.53 | 1.48 | 0.92 | 1.29 | 1.41 | 0.38 | 0.58 | 0.48 | 0.39 | 0.48 | 0.56 | 0.63 | 0.73 | 0.45 | 0.89 | 0.74 | 0.51 | 1.38 | 1.63 | 1.55 | 1.59 | 1.15 |
| FA hydroxy(8:0) hydroxy-octanoic acid | ME917761 | 1.50 | 0.83 | 0.83 | 0.48 | 0.65 | 0.54 | 0.47 | 0.62 | 0.69 | 0.57 | 0.87 | 0.52 | 1.12 | 0.94 | 1.09 | 1.40 | 1.58 | 1.55 | 1.64 | 1.72 | 1.25 | 1.01 | 1.50 | 1.52 | 1.31 | 1.06 | 1.47 | 1.50 | 1.19 | 1.06 | 1.75 | 1.33 | 1.02 | 0.90 | 0.95 | 1.06 | 0.49 | 0.86 | 0.59 | 0.37 | 0.62 | 0.80 | 0.85 | 1.14 | 0.38 | 0.50 | 0.69 | 0.41 | 1.18 | 1.60 | 1.51 | 1.53 | 0.99 |
| Thymine | ME917729 | 0.86 | 0.51 | 0.55 | 0.28 | 0.56 | 0.81 | 0.44 | 0.70 | 0.65 | 0.49 | 0.79 | 0.48 | 1.12 | 0.97 | 1.51 | 1.51 | 1.80 | 1.76 | 1.79 | 1.86 | 1.42 | 1.14 | 1.59 | 1.73 | 1.46 | 0.78 | 1.61 | 1.01 | 1.35 | 1.21 | 1.90 | 1.51 | 1.15 | 0.74 | 1.08 | 1.17 | 0.47 | 0.81 | 0.47 | 0.32 | 0.45 | 0.57 | 0.72 | 0.85 | 0.36 | 0.49 | 0.58 | 0.47 | 0.84 | 1.82 | 1.72 | 1.67 | 1.07 |
| Hexose phosphate | ME917626 | 1.16 | 0.60 | 0.67 | 0.30 | 0.56 | 0.91 | 0.55 | 0.68 | 0.72 | 0.48 | 0.77 | 0.43 | 1.18 | 0.96 | 1.48 | 1.51 | 1.89 | 1.29 | 1.45 | 1.86 | 1.34 | 1.19 | 1.57 | 1.64 | 1.63 | 1.24 | 1.70 | 1.96 | 1.34 | 1.08 | 1.44 | 1.14 | 1.17 | 0.66 | 0.73 | 1.02 | 0.42 | 0.88 | 0.60 | 0.36 | 0.58 | 0.67 | 0.74 | 0.84 | 0.29 | 0.57 | 0.59 | 0.36 | 1.20 | 1.27 | 1.16 | 1.20 | 0.99 |
| Phytuberin | ME917550 | 0.79 | 0.51 | 0.48 | 0.22 | 0.54 | 0.87 | 0.53 | 0.68 | 0.74 | 0.47 | 0.83 | 0.44 | 1.22 | 1.06 | 1.38 | 1.53 | 1.66 | 1.56 | 1.56 | 1.90 | 1.41 | 0.86 | 1.58 | 1.60 | 1.58 | 1.15 | 1.92 | 1.80 | 1.36 | 1.20 | 1.78 | 1.40 | 1.05 | 0.74 | 0.79 | 1.13 | 0.38 | 0.80 | 0.49 | 0.37 | 0.41 | 0.47 | 0.69 | 0.77 | 0.27 | 0.37 | 0.54 | 0.31 | 1.27 | 1.42 | 1.60 | 1.47 | 1.08 |
| (R)-Lactate | ME917555 | 0.74 | 0.43 | 0.50 | 0.26 | 0.69 | 0.92 | 0.70 | 0.67 | 0.71 | 0.49 | 0.76 | 0.48 | 1.21 | 1.13 | 1.45 | 1.57 | 2.09 | 1.59 | 1.47 | 1.99 | 1.18 | 1.20 | 1.33 | 1.31 | 1.39 | 1.07 | 1.64 | 1.40 | 1.21 | 1.35 | 1.77 | 1.35 | 1.10 | 0.72 | 0.88 | 0.90 | 0.47 | 0.73 | 0.56 | 0.43 | 0.42 | 0.54 | 0.69 | 0.86 | 0.34 | 0.52 | 0.54 | 0.51 | 1.17 | 1.60 | 1.41 | 1.32 | 1.25 |
| (1-Ribosylimidazole)-4-acetate | ME917859 | 0.72 | 0.44 | 0.39 | 0.36 | 0.66 | 0.63 | 0.65 | 0.60 | 0.77 | 0.65 | 0.82 | 0.56 | 1.35 | 1.11 | 1.08 | 1.50 | 1.48 | 1.56 | 1.92 | 1.42 | 0.98 | 1.17 | 1.61 | 1.57 | 1.54 | 1.13 | 2.03 | 1.41 | 1.39 | 1.47 | 2.00 | 2.02 | 1.12 | 0.86 | 1.03 | 1.33 | 0.29 | 0.62 | 0.50 | 0.45 | 0.36 | 0.60 | 0.72 | 0.69 | 0.29 | 0.53 | 0.72 | 0.55 | 0.64 | 1.19 | 1.23 | 1.17 | 1.09 |
| 2-Hydroxy-2,4-pentadienoate | ME917765 | 0.63 | 0.54 | 0.60 | 0.47 | 0.79 | 0.86 | 0.82 | 0.73 | 0.75 | 0.87 | 0.61 | 0.69 | 1.66 | 1.47 | 1.86 | 1.88 | 1.63 | 1.75 | 1.77 | 1.69 | 1.07 | 1.30 | 1.16 | 1.21 | 1.57 | 1.14 | 1.72 | 1.60 | 1.50 | 1.31 | 1.92 | 1.63 | 1.00 | 0.78 | 0.68 | 1.02 | 0.72 | 0.83 | 0.66 | 0.62 | 0.55 | 0.74 | 0.77 | 0.79 | 0.50 | 0.70 | 0.77 | 0.65 | 1.23 | 1.31 | 1.11 | 1.21 | 1.09 |
| Glu-Arg | ME917548 | NA | 0.22 | NA | 0.17 | 0.36 | 1.01 | 0.28 | 0.66 | 0.75 | 0.59 | 0.61 | 0.47 | 1.15 | 1.00 | 1.01 | 1.28 | 1.42 | 1.72 | 1.48 | 1.65 | 1.08 | 1.08 | 1.29 | 1.48 | 1.03 | 0.91 | 1.24 | 1.15 | 1.36 | 1.67 | 1.17 | 1.24 | 1.18 | 0.88 | 0.98 | 1.05 | NA | 0.60 | 0.39 | NA | 0.25 | 0.48 | 0.62 | 0.34 | 0.22 | 0.80 | 0.65 | 0.67 | 1.51 | 2.29 | 2.26 | 2.27 | 1.02 |
| D-Ribose 5-phosphate | ME917740 | 0.33 | 0.31 | 0.28 | 0.24 | 0.78 | 0.98 | 0.72 | 0.70 | 0.88 | 0.63 | 0.70 | 0.50 | 0.98 | 1.12 | 1.12 | 1.55 | 1.80 | 1.86 | 1.77 | 1.61 | 1.24 | 1.87 | 1.26 | 0.95 | 1.26 | 0.96 | 1.34 | 1.31 | 0.98 | 1.09 | 1.00 | 1.23 | 1.14 | 0.99 | 0.97 | 0.88 | 0.40 | 0.53 | 0.54 | 0.49 | 0.56 | 0.49 | 0.69 | 0.50 | 0.52 | 1.05 | 0.67 | 0.48 | 1.39 | 2.12 | 2.01 | 2.09 | 1.11 |
| Orotate(Fragment) | ME917945 | 0.39 | 0.29 | 0.37 | 0.19 | 0.58 | 0.76 | 0.50 | 0.50 | 0.64 | 0.49 | 0.60 | 0.43 | 1.52 | 1.31 | 1.59 | 1.46 | 1.76 | 1.77 | 1.38 | 1.45 | 1.45 | 1.68 | 1.39 | 1.22 | 1.41 | 1.00 | 1.32 | 1.03 | 1.36 | 1.31 | 1.41 | 1.23 | 1.23 | 0.86 | 1.07 | 0.97 | 0.37 | 0.48 | 0.45 | 0.28 | 0.54 | 0.65 | 0.72 | 0.65 | 0.38 | 0.90 | 0.64 | 0.57 | 1.30 | 2.04 | 2.05 | 2.05 | 0.99 |
| N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate | ME917874 | 0.68 | 0.54 | 0.47 | 0.23 | 0.43 | 0.83 | NA | 0.76 | 0.65 | 0.38 | 0.80 | 0.33 | 0.28 | 1.16 | 0.55 | 1.30 | 1.99 | 1.68 | 1.70 | 1.76 | 1.58 | 1.50 | 2.00 | 1.88 | 1.03 | 0.67 | 1.17 | 1.05 | 1.14 | 1.48 | 1.90 | 1.11 | 1.46 | 0.71 | 0.94 | 1.20 | 0.13 | 0.73 | 0.41 | NA | 0.51 | 0.59 | 0.68 | 0.80 | 0.45 | 0.69 | 0.74 | 0.33 | 1.31 | 1.70 | 1.61 | 1.57 | 1.39 |
| Phenylpropanoate | ME917742 | 0.52 | 0.39 | 0.35 | 0.21 | 0.55 | 0.76 | 0.46 | 0.60 | 0.70 | 0.45 | 0.72 | 0.47 | 0.96 | 0.79 | 1.05 | 1.22 | 1.76 | 1.70 | 1.80 | 1.71 | 1.44 | 1.62 | 1.82 | 1.77 | 0.96 | 0.73 | 1.13 | 1.09 | 1.36 | 1.39 | 1.89 | 1.69 | 1.50 | 0.88 | 1.29 | 1.42 | 0.33 | 0.52 | 0.39 | 0.24 | 0.38 | 0.45 | 0.57 | 0.64 | 0.45 | 0.76 | 0.71 | 0.46 | 1.43 | 2.15 | 2.06 | 2.17 | 1.09 |
| Val-Val-Pro | ME918013 | 0.47 | 0.36 | 0.37 | 0.25 | 0.58 | 0.86 | 0.54 | 0.69 | 0.74 | 0.56 | 0.75 | 0.54 | 1.00 | 0.93 | 1.09 | 1.22 | 1.59 | 1.54 | 1.67 | 1.67 | 1.57 | 1.73 | 1.84 | 1.77 | 1.00 | 0.79 | 1.05 | 1.09 | 1.38 | 1.35 | 1.84 | 1.61 | 1.50 | 1.00 | 1.34 | 1.49 | 0.35 | 0.54 | 0.42 | 0.28 | 0.39 | 0.49 | 0.53 | 0.79 | 0.49 | 0.81 | 0.71 | 0.53 | 2.21 | 2.14 | 2.17 | 2.22 | 1.16 |
| CAPS | ME917989 | 0.46 | 0.30 | 0.28 | 0.15 | 0.57 | 0.90 | 0.35 | 0.55 | 0.67 | 0.47 | 0.79 | 0.43 | 1.02 | 0.79 | 1.00 | 1.12 | 1.88 | 1.50 | 1.97 | 1.80 | 1.72 | 1.65 | 1.93 | 1.74 | 1.01 | 0.74 | 1.10 | 1.08 | 1.53 | 1.32 | 1.74 | 1.50 | 1.65 | 0.98 | 1.23 | 1.40 | 0.30 | 0.55 | 0.38 | 0.24 | 0.27 | 0.40 | 0.55 | 0.71 | 0.44 | 0.75 | 0.66 | 0.51 | 1.72 | 1.70 | 1.62 | 1.70 | 1.19 |
| 9-mercaptodethiobiotin | ME918008 | 0.55 | 0.35 | 0.40 | 0.27 | 0.65 | 0.93 | 0.56 | 0.69 | 0.73 | 0.58 | 0.72 | 0.49 | 1.02 | 1.05 | 1.18 | 1.04 | 1.75 | 1.64 | 1.60 | 1.50 | 1.59 | 1.56 | 1.59 | 1.68 | 1.01 | 0.76 | 1.02 | 1.07 | 1.41 | 1.25 | 1.65 | 1.49 | 1.36 | 0.98 | 1.17 | 1.25 | 0.44 | 0.59 | 0.48 | 0.31 | 0.34 | 0.54 | 0.55 | 0.73 | 0.57 | 0.83 | 0.73 | 0.47 | 1.71 | 1.78 | 1.67 | 1.66 | 1.04 |
| Ala-Ala-Pro | ME918004 | 0.61 | 0.34 | 0.42 | 0.28 | 0.61 | 0.87 | 0.53 | 0.64 | 0.82 | 0.62 | 0.78 | 0.54 | 0.96 | 0.98 | 1.05 | 1.07 | 1.65 | 1.62 | 1.50 | 1.41 | 1.57 | 1.49 | 1.50 | 1.65 | 1.05 | 0.77 | 1.03 | 1.07 | 1.54 | 1.41 | 1.58 | 1.50 | 1.45 | 0.99 | 1.23 | 1.22 | 0.41 | 0.61 | 0.37 | 0.35 | 0.38 | 0.49 | 0.64 | 0.83 | 0.54 | 0.85 | 0.77 | 0.52 | 1.78 | 1.65 | 1.57 | 1.72 | 1.16 |
| α,α^-Trehalose 6-phosphate | ME917579 | 0.51 | 0.32 | 0.36 | 0.22 | 0.57 | 0.89 | 0.59 | 0.50 | 0.50 | 0.47 | 0.84 | 0.49 | 0.96 | 1.02 | 1.13 | 1.22 | 1.72 | 1.48 | 1.69 | 1.67 | 1.28 | 1.42 | 1.95 | 1.77 | 1.33 | 0.81 | 1.15 | 1.09 | 1.50 | 1.14 | 1.59 | 1.14 | 1.50 | 0.76 | 1.01 | 1.17 | 0.35 | 0.63 | 0.47 | 0.28 | 0.40 | 0.58 | 0.65 | 0.95 | NA | 0.88 | 0.71 | 0.52 | 1.43 | 1.92 | 1.54 | 1.72 | 1.22 |
| 3-Oxododecanoic acid | ME917679 | 0.58 | 0.33 | 0.38 | 0.27 | 0.66 | 0.86 | 0.59 | 0.65 | 0.77 | 0.57 | 0.78 | 0.51 | 0.90 | 0.99 | 1.17 | 1.38 | 1.50 | 1.58 | 1.67 | 1.72 | 1.38 | 1.24 | 1.70 | 1.43 | 1.02 | 0.97 | 1.50 | 1.31 | 1.45 | 1.19 | 1.93 | 1.60 | 1.33 | 0.72 | 1.06 | 1.28 | 0.35 | 0.68 | 0.50 | 0.34 | 0.50 | 0.44 | 0.73 | 0.73 | 0.40 | 0.56 | 0.79 | 0.49 | 1.57 | 1.57 | 1.56 | 1.69 | 1.13 |
| Sulfoacetate | ME917675 | 0.43 | 0.33 | 0.29 | 0.22 | 0.63 | 0.82 | 0.47 | 0.65 | 0.62 | 0.55 | 0.80 | 0.54 | 1.14 | 1.04 | 1.27 | 1.30 | 1.62 | 1.60 | 1.62 | 1.68 | 0.97 | 1.33 | 1.52 | 1.82 | 1.26 | 0.86 | 1.42 | 1.23 | 1.21 | 1.34 | 1.53 | 1.46 | 1.26 | 0.89 | 0.97 | 1.28 | 0.39 | 0.54 | 0.47 | 0.33 | 0.38 | 0.53 | 0.75 | 0.92 | 0.45 | 0.70 | 0.73 | 0.45 | 1.66 | 1.88 | 1.84 | 1.94 | 1.10 |
| [FA (16:2)] N-hexadecyl-ethanolamine | ME917777 | NA | NA | NA | NA | NA | 0.46 | NA | NA | 0.61 | NA | 0.49 | NA | 0.96 | 0.52 | 0.74 | 0.82 | 1.26 | 0.89 | 0.84 | 1.29 | 1.67 | 1.06 | 1.28 | 1.49 | 0.94 | 0.50 | 1.08 | 0.77 | 1.31 | 0.72 | 1.67 | 0.70 | 1.05 | 0.57 | 0.64 | 0.97 | NA | 0.51 | NA | NA | 0.39 | 0.41 | 0.41 | 0.61 | NA | 0.71 | 0.33 | NA | 0.93 | 2.89 | 2.69 | 2.56 | 1.26 |
| Phenyllactate | ME917808 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.21 | NA | 0.76 | 0.40 | 1.35 | 1.37 | 1.30 | 0.89 | 1.53 | 1.07 | 1.45 | 1.16 | 1.20 | 1.02 | 0.41 | NA | 0.88 | 1.13 | 0.39 | 0.43 | 1.53 | 0.95 | 0.63 | 0.29 | 0.46 | 0.67 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.22 | NA | 0.84 | 2.53 | 2.21 | 2.07 | 0.65 |
| (S)-Lactate | ME917728 | NA | NA | NA | NA | NA | 0.46 | 0.22 | NA | 0.20 | 0.17 | 0.19 | NA | 1.65 | 1.39 | 1.94 | 1.83 | 2.85 | 1.93 | 1.54 | 1.86 | 1.56 | 1.27 | 0.88 | 1.03 | 0.82 | 0.57 | 1.20 | 0.92 | 0.82 | 0.74 | 1.12 | 1.25 | 0.56 | 0.22 | 0.75 | 0.58 | 0.20 | 0.58 | 0.24 | 0.27 | 0.16 | 0.24 | 0.25 | 0.23 | NA | 0.20 | 0.19 | NA | 1.28 | 3.02 | 3.33 | 3.35 | 0.84 |
| PA(32:2) | ME917625 | NA | NA | NA | NA | 0.31 | 0.34 | 0.17 | 0.15 | 0.33 | 0.34 | 0.40 | 0.11 | 0.74 | 0.53 | 0.90 | 0.77 | 1.54 | 1.95 | 2.26 | 1.78 | 1.83 | 1.64 | 2.08 | 1.46 | 0.61 | 0.44 | 0.76 | 0.66 | 1.33 | 1.20 | 2.09 | 1.72 | 0.89 | 0.48 | 0.93 | 0.97 | NA | NA | 0.09 | NA | 0.13 | 0.40 | 0.53 | 0.50 | 0.62 | 1.50 | 0.97 | 0.53 | 1.04 | 2.38 | 2.33 | 2.35 | 0.94 |
| Pentanoate | ME917877 | 0.36 | NA | 0.21 | NA | 0.48 | 0.59 | 0.22 | 0.43 | 0.56 | 0.23 | 0.46 | 0.49 | 0.81 | 0.79 | 0.77 | 1.09 | 2.23 | 2.56 | 1.29 | 1.64 | 2.82 | 3.08 | 2.31 | 1.75 | 0.90 | 0.59 | 0.99 | 0.71 | 1.42 | 1.00 | 1.28 | 1.13 | 1.46 | 0.48 | 1.14 | 1.09 | 0.14 | 0.34 | 0.25 | NA | 0.17 | 0.33 | 0.42 | 0.27 | 0.21 | 0.49 | 0.48 | 0.41 | 1.23 | 2.35 | 2.07 | 2.58 | 0.89 |
| 2-Octenedioicacid | ME917622 | 1.12 | 0.69 | 0.45 | NA | 0.47 | 0.89 | NA | NA | 0.72 | 0.56 | 0.69 | 0.40 | 0.87 | 0.79 | 0.93 | 1.20 | 1.17 | 1.12 | 0.92 | 1.15 | 0.74 | 0.71 | 1.03 | 1.15 | 1.15 | 0.68 | 1.21 | 1.30 | 1.13 | 1.17 | 1.33 | 1.53 | 1.06 | 0.86 | 1.00 | 1.10 | NA | 0.84 | 0.59 | NA | 0.40 | 0.66 | 0.65 | 0.49 | NA | NA | 0.36 | NA | 0.94 | 2.74 | 2.67 | 2.54 | 0.84 |
| Phe-Gly-Pro-Pro | ME917889 | 0.24 | 0.17 | NA | NA | 0.23 | 0.50 | NA | NA | 0.54 | 0.26 | 0.45 | 0.22 | 1.19 | 0.82 | 1.86 | 1.33 | 0.75 | 1.51 | 1.51 | 1.72 | 2.69 | 1.67 | 1.73 | 1.33 | 1.12 | 0.60 | 1.09 | 1.10 | 1.00 | 0.62 | 1.68 | 1.05 | 0.67 | 0.53 | 1.11 | 1.07 | 0.24 | 0.27 | 0.24 | 0.22 | 0.19 | 0.38 | 0.28 | 0.40 | 0.37 | 0.30 | 0.58 | 0.38 | 1.45 | 3.20 | 3.55 | 3.38 | 1.22 |
| D-Erythrose | ME917544 | 0.33 | 0.20 | 0.22 | 0.08 | 0.43 | 0.76 | 0.61 | 0.50 | 0.68 | 0.38 | 0.54 | 0.35 | 0.88 | 1.50 | 0.97 | 1.08 | 1.37 | 1.90 | 1.07 | 1.50 | 2.61 | 0.98 | 1.87 | 1.30 | 1.06 | 0.76 | 1.21 | 1.16 | 1.73 | 1.27 | 1.75 | 1.30 | 1.03 | 0.61 | 0.83 | 1.52 | 0.27 | 0.47 | 0.32 | 0.22 | 0.29 | 0.32 | 0.53 | 0.53 | 0.21 | 0.51 | 0.56 | 0.35 | 1.80 | 2.84 | 2.99 | 2.85 | 1.59 |
| CoA | ME917564 | 0.62 | 0.40 | 0.55 | 0.25 | 0.25 | 0.45 | 0.33 | 0.25 | 0.32 | 0.21 | 0.33 | 0.15 | 1.16 | 1.15 | 1.26 | 1.14 | 1.93 | 2.35 | 1.84 | 1.45 | 2.89 | 1.75 | 2.62 | 1.42 | 1.25 | 0.99 | 1.34 | 1.23 | 1.34 | 1.25 | 1.36 | 1.12 | 0.87 | 0.40 | 0.73 | 0.82 | 0.12 | 0.15 | 0.17 | 0.15 | 0.34 | 0.45 | 0.43 | 0.39 | 0.20 | 0.56 | 0.31 | 0.21 | 1.26 | 3.14 | 3.20 | 3.17 | 1.02 |
| Octadecanoic acid | ME917560 | 0.71 | 0.45 | 0.59 | 0.30 | 0.28 | 0.45 | 0.33 | 0.29 | 0.33 | 0.20 | 0.34 | 0.17 | 1.19 | 1.11 | 1.24 | 1.07 | 1.93 | 2.28 | 1.92 | 1.50 | 2.74 | 1.82 | 2.58 | 1.54 | 1.37 | 0.97 | 1.36 | 1.12 | 1.30 | 1.12 | 1.42 | 1.10 | 0.91 | 0.44 | 0.74 | 0.79 | 0.11 | 0.16 | 0.19 | 0.17 | 0.32 | 0.48 | 0.49 | 0.43 | 0.22 | 0.58 | 0.36 | 0.22 | 1.17 | 2.93 | 3.12 | 3.06 | 1.05 |
| 4-Methyl-2-oxopentanoate | ME917646 | 0.45 | 0.28 | 0.29 | 0.12 | 0.43 | 0.61 | 0.34 | 0.44 | 0.53 | 0.37 | 0.55 | 0.35 | 1.33 | 0.91 | 1.02 | 1.07 | 1.69 | 2.05 | 1.38 | 1.55 | 2.05 | 1.21 | 2.09 | 1.39 | 1.06 | 0.72 | 1.16 | 1.09 | 1.12 | 0.93 | 1.44 | 1.16 | 1.08 | 0.66 | 0.86 | 1.17 | 0.25 | 0.49 | 0.38 | 0.21 | 0.29 | 0.38 | 0.46 | 0.54 | 0.22 | 0.43 | 0.54 | 0.29 | 2.15 | 3.66 | 3.46 | 3.50 | 0.83 |
| (R)-2,3-Dihydroxy-3-methylpentanoate | ME917969 | 0.51 | 0.30 | 0.32 | 0.16 | 0.45 | 0.63 | 0.35 | 0.45 | 0.55 | 0.38 | 0.58 | 0.36 | 1.38 | 0.94 | 1.06 | 1.10 | 1.75 | 2.13 | 1.30 | 1.60 | 2.12 | 1.15 | 2.16 | 1.44 | 1.10 | 0.74 | 1.20 | 0.99 | 1.16 | 0.97 | 1.49 | 1.21 | 1.11 | 0.68 | 0.89 | 1.21 | 0.25 | 0.46 | 0.34 | 0.21 | 0.30 | 0.44 | 0.47 | 0.62 | 0.22 | 0.45 | 0.56 | 0.30 | 0.59 | 3.79 | 3.59 | 3.63 | 0.86 |
| Glycerol 1-propanoate | ME917672 | 0.43 | 0.32 | 0.49 | 0.13 | 0.45 | 0.61 | 0.43 | 0.41 | 0.53 | 0.38 | 0.49 | 0.31 | 1.24 | 1.44 | 1.35 | 1.37 | 1.88 | 2.28 | 1.74 | 1.49 | 1.98 | 1.71 | 1.57 | 1.20 | 1.38 | 0.99 | 1.28 | 1.13 | 1.49 | 1.36 | 1.93 | 1.32 | 1.19 | 0.72 | 0.87 | 0.97 | 0.25 | 0.41 | 0.28 | 0.13 | 0.38 | 0.54 | 0.68 | 0.62 | 0.33 | 0.57 | 0.41 | 0.33 | 1.15 | 2.20 | 2.38 | 2.41 | 1.08 |
| Tyrosyl-Valine | ME917941 | 0.37 | 0.28 | 0.39 | 0.16 | 0.34 | 0.57 | 0.42 | 0.34 | 0.47 | 0.29 | 0.39 | 0.22 | 1.26 | 1.32 | 1.46 | 1.41 | 2.10 | 2.57 | 1.61 | 1.55 | 2.08 | 1.59 | 1.72 | 1.28 | 1.39 | 1.02 | 1.35 | 1.18 | 1.55 | 1.50 | 1.72 | 1.31 | 1.15 | 0.64 | 0.90 | 0.97 | 0.19 | 0.26 | 0.28 | 0.19 | 0.39 | 0.47 | 0.61 | 0.51 | 0.20 | 0.61 | 0.38 | 0.30 | 1.19 | 2.53 | 2.54 | 2.42 | 1.07 |
| N-Acetyl-L-aspartate | ME917868 | 0.16 | 0.15 | 0.16 | 0.10 | 0.47 | 0.66 | 0.43 | 0.37 | 0.49 | 0.41 | 0.60 | 0.38 | 1.38 | 1.09 | 1.44 | 1.31 | 1.67 | 1.93 | 1.75 | 1.60 | 1.51 | 1.83 | 1.92 | 1.48 | 1.33 | 0.92 | 1.46 | 1.19 | 1.29 | 1.32 | 1.73 | 1.59 | 1.21 | 0.70 | 1.15 | 1.17 | 0.23 | 0.32 | 0.35 | 0.21 | 0.42 | 0.55 | 0.69 | 0.63 | 0.34 | 0.78 | 0.58 | 0.47 | 1.50 | 2.18 | 2.20 | 2.15 | 1.08 |
| N-Acetyl-L-phenylalanine | ME917867 | 0.16 | 0.15 | 0.16 | 0.10 | 0.47 | 0.66 | 0.43 | 0.38 | 0.49 | 0.38 | 0.60 | 0.39 | 1.37 | 1.06 | 1.45 | 1.32 | 1.68 | 1.94 | 1.72 | 1.61 | 1.52 | 1.78 | 1.94 | 1.44 | 1.34 | 0.92 | 1.47 | 1.20 | 1.42 | 1.33 | 1.70 | 1.52 | 1.22 | 0.71 | 1.16 | 1.18 | 0.23 | 0.32 | 0.35 | 0.21 | 0.42 | 0.55 | 0.62 | 0.63 | 0.33 | 0.78 | 0.55 | 0.44 | 1.53 | 2.24 | 2.20 | 2.13 | 1.11 |
| Glycerone phosphate | ME917871 | 0.18 | 0.12 | 0.15 | 0.07 | 0.47 | 0.61 | 0.49 | 0.43 | 0.46 | 0.33 | 0.47 | 0.24 | 1.21 | 1.07 | 1.58 | 1.41 | 2.01 | 1.97 | 1.53 | 1.63 | 1.99 | 1.59 | 1.89 | 1.34 | 1.33 | 0.92 | 1.70 | 1.32 | 1.54 | 1.56 | 1.98 | 1.51 | 1.12 | 0.62 | 1.07 | 1.00 | 0.20 | 0.28 | 0.28 | 0.18 | 0.43 | 0.52 | 0.79 | 0.67 | 0.26 | 0.72 | 0.49 | 0.40 | 1.14 | 2.29 | 2.21 | 2.23 | 1.00 |
| N-Acetyl-L-glutamate 5-semialdehyde | ME917869 | 0.18 | 0.12 | 0.15 | 0.07 | 0.47 | 0.66 | 0.50 | 0.47 | 0.50 | 0.31 | 0.44 | 0.24 | 1.38 | 1.12 | 1.64 | 1.39 | 1.98 | 2.05 | 1.67 | 1.61 | 1.87 | 1.62 | 1.81 | 1.33 | 1.28 | 0.92 | 1.77 | 1.30 | 1.58 | 1.52 | 1.86 | 1.50 | 1.11 | 0.62 | 1.00 | 1.00 | 0.22 | 0.31 | 0.27 | 0.17 | 0.45 | 0.53 | 0.83 | 0.65 | 0.26 | 0.73 | 0.50 | 0.39 | 1.15 | 2.19 | 2.15 | 2.16 | 1.03 |
| 2^-Hydroxydaidzein | ME917627 | 0.17 | 0.13 | NA | NA | 0.51 | 0.63 | 0.32 | 0.31 | 0.50 | 0.35 | 0.39 | 0.26 | 1.65 | 1.15 | 1.82 | 1.46 | 1.74 | 1.76 | 1.42 | 1.10 | 1.30 | 1.54 | 1.26 | 0.96 | 1.39 | 1.03 | 1.59 | 1.30 | 1.19 | 0.93 | 1.40 | 1.29 | 0.86 | 0.55 | 0.73 | 0.96 | 0.18 | 0.38 | 0.41 | 0.23 | 0.54 | 0.73 | 0.78 | 0.81 | 0.43 | 0.62 | 0.45 | 0.49 | 1.28 | 2.71 | 2.79 | 3.24 | 0.97 |
| Lys-Pro | ME917975 | 0.54 | 0.39 | 0.50 | 0.20 | 0.45 | 0.65 | 0.52 | 0.44 | 0.56 | 0.36 | 0.46 | 0.29 | 1.41 | 1.50 | 1.38 | 1.47 | 1.99 | 2.27 | 1.37 | 1.44 | 1.68 | 1.22 | 1.42 | 1.09 | 1.54 | 1.13 | 1.29 | 1.18 | 1.33 | 1.17 | 1.59 | 1.15 | 0.75 | 0.57 | 0.71 | 0.93 | 0.33 | 0.47 | 0.42 | 0.28 | 0.53 | 0.55 | 0.59 | 0.44 | 0.23 | 0.57 | 0.51 | 0.39 | 1.29 | 2.82 | 2.84 | 2.66 | 1.11 |
| Ala-Asn-Ser | ME917950 | 0.32 | 0.23 | 0.32 | 0.14 | 0.34 | 0.45 | 0.31 | 0.27 | 0.39 | 0.26 | 0.38 | 0.19 | 1.55 | 1.21 | 1.72 | 1.55 | 2.08 | 2.25 | 1.75 | 1.61 | 1.65 | 1.80 | 1.59 | 1.20 | 1.50 | 1.06 | 1.66 | 1.20 | 1.35 | 1.24 | 1.64 | 1.35 | 1.05 | 0.52 | 0.81 | 0.80 | 0.15 | 0.22 | 0.23 | 0.13 | 0.43 | 0.62 | 0.77 | 0.61 | 0.23 | 0.56 | 0.42 | 0.30 | 1.23 | 2.75 | 2.97 | 2.71 | 0.96 |
| Apigenin | ME917904 | 0.33 | 0.22 | 0.34 | 0.13 | 0.31 | 0.43 | 0.30 | 0.27 | 0.36 | 0.29 | 0.38 | 0.20 | 1.47 | 1.15 | 1.69 | 1.48 | 2.04 | 2.10 | 1.67 | 1.61 | 1.62 | 1.68 | 1.60 | 1.21 | 1.49 | 1.09 | 1.64 | 1.23 | 1.35 | 1.21 | 1.57 | 1.38 | 1.10 | 0.50 | 0.88 | 0.83 | 0.16 | 0.23 | 0.23 | 0.12 | 0.45 | 0.61 | 0.81 | 0.67 | 0.24 | 0.52 | 0.43 | 0.33 | 1.27 | 2.91 | 2.94 | 2.92 | 0.98 |
| Alanyl-Proline | ME917716 | 0.39 | 0.27 | 0.38 | 0.24 | 0.48 | 0.55 | 0.48 | 0.42 | 0.55 | 0.48 | 0.51 | 0.41 | 1.67 | 1.08 | 1.61 | 1.55 | 2.26 | 2.02 | 1.73 | 1.63 | 1.87 | 1.86 | 1.74 | 1.43 | 1.42 | 0.82 | 1.60 | 1.23 | 1.13 | 1.08 | 1.81 | 1.31 | 1.31 | 0.63 | 1.05 | 0.99 | 0.36 | 0.45 | 0.41 | 0.37 | 0.51 | 0.61 | 0.72 | 0.45 | 0.37 | 0.58 | 0.60 | 0.43 | 2.20 | 2.62 | 2.63 | 2.76 | 1.11 |
| Jubanine B | ME918014 | 0.28 | 0.23 | 0.32 | 0.18 | 0.57 | 0.81 | 0.45 | 0.54 | 0.63 | 0.53 | 0.65 | 0.44 | 1.65 | 1.28 | 1.32 | 1.44 | 1.49 | 1.45 | 1.63 | 1.37 | 1.26 | 1.74 | 1.49 | 1.16 | 1.23 | 0.86 | 1.39 | 0.99 | 1.15 | 1.01 | 1.30 | 1.25 | 1.63 | 0.81 | 1.14 | 1.00 | 0.44 | 0.63 | 0.59 | 0.43 | 0.29 | 0.50 | 0.58 | 0.80 | 0.33 | 0.67 | 0.52 | 0.38 | 2.29 | 2.45 | 2.46 | 2.86 | 1.14 |
| 19-oic-deoxycorticosterone | ME917821 | 0.45 | 0.28 | 0.34 | 0.27 | 0.84 | 0.82 | 0.62 | 0.46 | 0.89 | 0.70 | 0.81 | 0.52 | 1.39 | 1.25 | 1.26 | 1.43 | 1.48 | 1.78 | 1.76 | 1.40 | 1.84 | 1.48 | 1.08 | 1.27 | 0.72 | 1.04 | 1.16 | 1.13 | 1.03 | 1.16 | 1.68 | 1.57 | 1.04 | 0.63 | 0.81 | 0.83 | 0.32 | 0.38 | 0.61 | 0.31 | 0.32 | 0.66 | 0.73 | 0.55 | 0.28 | 0.85 | 0.66 | 0.38 | 1.89 | 2.64 | 2.96 | 3.03 | 0.92 |
| [PR] 1^-Hydroxy-4-keto-gamma-carotene glucoside/ 1^-OH-4-Keto-gamma-carotene glucoside/ (Carotenoid K-G) | ME917846 | 0.84 | 0.25 | 0.27 | 0.18 | 0.60 | 0.73 | 0.38 | 0.64 | 0.56 | 0.28 | 0.69 | 0.49 | 1.12 | 0.99 | 1.01 | 1.48 | 1.52 | 1.78 | 1.66 | 1.74 | 1.24 | 1.16 | 1.70 | 1.44 | 1.37 | 0.94 | 1.49 | 1.41 | 1.28 | 1.17 | 1.71 | 1.53 | 1.10 | 0.65 | 0.61 | 1.02 | 0.25 | 0.59 | 0.54 | 0.26 | 0.33 | 0.49 | 0.59 | 0.58 | 0.21 | 0.69 | 0.57 | 0.31 | 1.17 | 2.83 | 2.82 | 2.82 | 0.89 |
| Acetoacetate | ME917798 | 0.62 | 0.43 | 0.56 | 0.20 | 0.58 | 0.69 | 0.29 | 0.36 | 0.66 | 0.48 | 0.69 | 0.55 | 1.02 | 1.26 | 1.30 | 1.51 | 1.47 | 1.53 | 1.77 | 1.27 | 1.23 | 1.36 | 1.51 | 1.39 | 1.11 | 0.93 | 1.34 | 1.26 | 1.13 | 0.93 | 1.90 | 1.50 | 1.32 | 0.93 | 1.07 | 1.14 | 0.27 | 0.65 | 0.41 | 0.20 | 0.50 | 0.58 | 0.73 | 0.85 | 0.26 | 0.66 | 0.58 | 0.32 | 1.16 | 2.52 | 2.58 | 2.41 | 1.03 |
| [PG (16:0)] 1-hexadecanoyl-sn-glycero-3-phospho-(1^-sn-glycerol) | ME917545 | 0.49 | 0.37 | 0.40 | 0.17 | 0.65 | 0.78 | 0.58 | 0.64 | 0.71 | 0.50 | 0.73 | 0.44 | 1.14 | 1.09 | 1.29 | 1.41 | 1.53 | 1.40 | 1.66 | 1.64 | 1.33 | 1.25 | 1.57 | 1.42 | 1.21 | 0.78 | 1.26 | 1.20 | 1.13 | 1.17 | 1.56 | 1.36 | 1.24 | 0.80 | 0.99 | 1.16 | 0.29 | 0.59 | 0.44 | 0.15 | 0.39 | 0.52 | 0.60 | 0.70 | 0.29 | 0.61 | 0.51 | 0.53 | 1.43 | 2.41 | 3.00 | 2.51 | 0.97 |
| Leu-Val-Pro | ME917952 | 0.17 | 0.17 | 0.19 | 0.08 | 0.61 | 0.79 | 0.57 | 0.60 | 0.66 | 0.44 | 0.69 | 0.48 | 1.52 | 1.25 | 1.50 | 1.31 | 1.43 | 1.60 | 1.62 | 1.39 | 1.29 | 1.76 | 1.54 | 1.20 | 1.06 | 0.81 | 1.35 | 0.92 | 1.30 | 1.20 | 1.55 | 1.59 | 1.38 | 0.80 | 1.13 | 1.13 | 0.32 | 0.42 | 0.53 | 0.33 | 0.42 | 0.51 | 0.67 | 0.63 | 0.21 | 0.48 | 0.47 | 0.35 | 1.51 | 2.90 | 3.07 | 2.98 | 1.08 |
| Succinate semialdehyde | ME917813 | 0.28 | 0.20 | 0.28 | 0.14 | 0.62 | 0.78 | 0.59 | 0.52 | 0.66 | 0.41 | 0.63 | 0.31 | 1.17 | 1.13 | 1.43 | 1.58 | 1.67 | 1.75 | 1.52 | 1.35 | 1.61 | 1.50 | 1.57 | 1.47 | 1.15 | 0.93 | 1.71 | 1.57 | 1.25 | 1.32 | 1.79 | 1.45 | 1.21 | 0.70 | 1.07 | 1.16 | 0.27 | 0.44 | 0.44 | 0.29 | 0.36 | 0.38 | 0.40 | 0.30 | 0.32 | 0.78 | 0.49 | 0.41 | 1.29 | 2.70 | 2.78 | 2.89 | 0.96 |
| (S)-3-Methyl-2-oxopentanoic acid | ME917673 | 0.28 | 0.24 | NA | NA | 0.61 | 0.76 | 0.43 | 0.47 | 0.51 | 0.31 | 0.61 | 0.58 | 0.94 | 1.05 | 1.21 | 1.15 | 1.52 | 1.28 | 1.47 | 1.65 | 1.07 | 0.91 | 1.62 | 1.23 | 1.48 | 1.05 | 1.66 | 1.59 | 1.18 | 0.97 | 2.08 | 1.60 | 0.98 | 0.70 | 0.84 | 0.86 | 0.24 | 0.51 | 0.31 | 0.28 | 0.39 | 0.25 | 0.53 | 0.34 | NA | 0.26 | 0.31 | NA | 1.15 | 3.12 | 2.47 | 2.91 | 1.04 |
| D-Sedoheptulose 7-phosphate | ME917570 | 0.42 | 0.36 | 0.30 | 0.22 | 0.82 | 0.99 | 0.79 | 0.77 | 0.46 | 0.33 | 0.78 | 0.64 | 1.18 | 0.96 | 1.35 | 1.72 | 1.37 | 1.43 | 1.78 | 1.89 | 1.02 | 0.95 | 1.47 | 1.47 | 1.61 | 1.06 | 1.81 | 1.76 | 1.02 | 1.00 | 1.48 | 1.47 | 0.80 | 0.72 | 0.40 | 0.90 | 0.40 | 0.70 | 0.59 | 0.33 | 0.31 | 0.30 | 0.64 | 0.93 | NA | 0.38 | 0.48 | 0.28 | 1.49 | 2.22 | 2.12 | 2.16 | 1.13 |
| mercapto-2-propanol | ME917849 | 0.81 | 0.34 | 0.35 | NA | 0.49 | 0.43 | 0.46 | 0.50 | 0.75 | 0.26 | 0.75 | 0.30 | 1.14 | 0.98 | 1.35 | 1.46 | 1.54 | 1.52 | 1.45 | 1.83 | 1.14 | 0.81 | 1.23 | 1.24 | 1.34 | 0.99 | 1.60 | 1.52 | 1.18 | 1.04 | 1.59 | 1.39 | 1.11 | 0.76 | 0.95 | 1.04 | NA | 1.01 | 0.26 | 0.39 | 0.70 | 0.78 | 0.36 | 0.51 | NA | NA | 0.45 | NA | 1.15 | 1.85 | 2.04 | 1.94 | 0.91 |
| Asp-Glu-Glu-Glu | ME917848 | 0.85 | 0.26 | 0.32 | NA | 0.48 | 0.66 | 0.54 | 0.42 | 0.71 | 0.31 | 0.57 | 0.29 | 0.95 | 0.86 | 1.52 | 1.05 | 1.60 | 1.46 | 1.28 | 1.22 | 1.14 | 1.03 | 1.45 | 1.09 | 1.05 | 0.75 | 0.87 | 1.01 | 0.79 | 0.78 | 1.06 | 1.40 | 0.77 | 0.76 | 1.04 | 1.01 | NA | 0.40 | 0.33 | NA | 0.32 | 0.58 | 0.36 | 0.42 | NA | 0.40 | 0.55 | NA | 1.12 | 3.71 | 3.82 | 3.94 | 0.69 |
| 4-Hydroxybenzaldehyde | ME917720 | 0.50 | 0.53 | 0.56 | 0.28 | 0.45 | 0.41 | 0.36 | 0.39 | 0.50 | 0.43 | 0.51 | 0.41 | 1.25 | 0.84 | 1.04 | 1.29 | 1.30 | 1.32 | 1.43 | 1.14 | 1.27 | 1.50 | 1.55 | 1.17 | 1.43 | 1.22 | 1.51 | 1.25 | 0.84 | 0.94 | 1.20 | 1.09 | 1.18 | 0.75 | 0.98 | 0.90 | 0.31 | 0.45 | 0.49 | 0.29 | 0.82 | 1.00 | 1.06 | 0.97 | 0.39 | 0.83 | 0.64 | 0.52 | 1.37 | 2.97 | 3.03 | 3.14 | 0.99 |
| Deoxyguanidinoproclavaminic acid | ME917707 | 0.51 | 0.53 | 0.56 | 0.28 | 0.45 | 0.41 | 0.36 | 0.39 | 0.50 | 0.43 | 0.51 | 0.41 | 1.25 | 0.85 | 1.04 | 1.30 | 1.31 | 1.32 | 1.44 | 1.14 | 1.27 | 1.18 | 1.32 | 0.98 | 1.43 | 1.23 | 1.51 | 1.25 | 0.84 | 0.94 | 1.20 | 1.10 | 1.18 | 0.75 | 0.98 | 0.90 | 0.29 | 0.45 | 0.49 | 0.29 | 0.77 | 1.00 | 1.06 | 0.97 | 0.39 | 0.83 | 0.64 | 0.52 | 1.39 | 3.25 | 3.52 | 3.09 | 0.95 |
| FA hydroxy(6:0) | ME917770 | 0.93 | 0.70 | 0.58 | 0.36 | 0.53 | 0.81 | 0.44 | 0.54 | 0.92 | 0.59 | 0.84 | 0.52 | 1.05 | 0.88 | 1.20 | 1.26 | 1.29 | 1.08 | 1.16 | 1.43 | 0.98 | 0.91 | 1.30 | 1.35 | 1.31 | 0.99 | 1.44 | 1.24 | 0.90 | 0.82 | 1.20 | 1.11 | 1.27 | 0.93 | 0.84 | 1.10 | 0.42 | 0.93 | 0.59 | 0.40 | 0.47 | 0.66 | 0.76 | 0.91 | 0.31 | 0.48 | 0.79 | 0.35 | 1.18 | 3.04 | 3.03 | 2.92 | 0.96 |
| Glu-Pro-Val | ME918001 | 0.94 | 0.71 | 0.58 | 0.32 | 0.54 | 0.81 | 0.44 | 0.63 | 0.94 | 0.57 | 0.86 | 0.54 | 1.03 | 0.90 | 1.22 | 1.28 | 1.31 | 1.10 | 1.18 | 1.45 | 1.00 | 0.92 | 1.31 | 1.37 | 1.30 | 0.95 | 0.88 | 1.25 | 0.91 | 0.83 | 1.22 | 1.12 | 1.28 | 0.94 | 0.85 | 1.11 | 0.43 | 0.94 | 0.60 | 0.38 | 0.47 | 0.67 | 0.77 | 0.92 | 0.35 | 0.49 | 0.80 | 0.35 | 1.16 | 3.08 | 3.07 | 2.96 | 0.97 |
| Ala-Ala-Asp-Pro | ME918011 | 0.82 | 0.43 | 0.43 | 0.27 | 0.53 | 0.72 | 0.35 | 0.57 | 0.73 | 0.48 | 0.83 | 0.57 | 1.13 | 0.83 | 1.04 | 1.18 | 1.58 | 1.42 | 1.30 | 1.52 | 1.15 | 1.11 | 1.33 | 1.62 | 1.14 | 0.79 | 1.13 | 1.16 | 1.07 | 0.88 | 1.25 | 1.09 | 1.38 | 0.91 | 0.96 | 1.10 | 0.42 | 0.78 | 0.59 | 0.45 | 0.45 | 0.80 | 0.77 | 0.84 | 0.33 | 0.63 | 0.61 | 0.41 | 1.65 | 2.88 | 2.92 | 2.83 | 0.82 |
| O-Acetyl-L-homoserine | ME917970 | 0.77 | 0.45 | 0.51 | 0.23 | 0.54 | 0.75 | 0.38 | 0.60 | 0.75 | 0.53 | 0.83 | 0.49 | 1.11 | 0.77 | 1.05 | 1.28 | 1.44 | 1.29 | 1.13 | 1.41 | 1.06 | 0.99 | 1.46 | 1.35 | 1.27 | 0.92 | 1.27 | 1.21 | 1.15 | 0.93 | 1.40 | 1.27 | 1.39 | 0.89 | 0.94 | 1.12 | 0.37 | 0.75 | 0.51 | 0.32 | 0.41 | 0.56 | 0.66 | 0.78 | 0.29 | 0.45 | 0.63 | 0.37 | 1.46 | 3.08 | 3.25 | 3.27 | 0.91 |
| FA (8:0) octanoic acid | ME917773 | 0.37 | 0.27 | 0.39 | 0.16 | 0.64 | 0.71 | 0.50 | 0.52 | 0.88 | 0.60 | 0.84 | 0.50 | 0.76 | 0.69 | 0.76 | 0.81 | 1.52 | 1.62 | 1.24 | 1.22 | 1.89 | 1.64 | 2.25 | 1.66 | 1.07 | 0.79 | 0.98 | 0.89 | 1.20 | 1.21 | 1.33 | 1.12 | 1.54 | 1.04 | 1.14 | 1.48 | 0.35 | 0.54 | 0.41 | 0.25 | 0.34 | 0.40 | 0.44 | 0.42 | 0.46 | 1.11 | 0.76 | 0.61 | 1.20 | 2.86 | 2.86 | 2.76 | 0.96 |
| Proclavaminic acid | ME917767 | 0.37 | 0.27 | 0.39 | 0.16 | 0.64 | 0.71 | 0.50 | 0.49 | 0.88 | 0.60 | 0.84 | 0.50 | 0.82 | 0.69 | 0.76 | 0.82 | 1.52 | 1.62 | 1.24 | 1.22 | 1.89 | 1.65 | 2.25 | 1.66 | 1.07 | 0.79 | 0.98 | 0.89 | 1.20 | 1.21 | 1.33 | 1.09 | 1.54 | 1.04 | 1.14 | 1.48 | 0.35 | 0.54 | 0.42 | 0.25 | 0.34 | 0.40 | 0.44 | 0.43 | 0.46 | 1.11 | 0.76 | 0.61 | 1.18 | 2.86 | 2.86 | 2.76 | 0.96 |
| L-Arginine | ME917979 | 0.27 | 0.26 | 0.34 | NA | 0.36 | 0.91 | 0.35 | 0.36 | 0.71 | 0.56 | 0.67 | 0.57 | 0.91 | 0.93 | 1.14 | 1.05 | 1.39 | 1.35 | 1.38 | 1.20 | 1.30 | 1.74 | 1.41 | 1.50 | 0.88 | 0.78 | 0.78 | 0.52 | 1.17 | 1.17 | 1.47 | 1.22 | 1.29 | 1.17 | 0.92 | 1.30 | 0.31 | 0.35 | 0.30 | NA | 0.55 | 0.64 | 0.79 | 0.78 | 0.34 | 1.05 | 0.73 | 0.76 | 1.40 | 3.04 | 2.77 | 2.88 | 0.99 |
| Ala-Gly-Pro-Pro | ME918007 | 0.35 | 0.23 | 0.25 | 0.20 | 0.42 | 0.92 | 0.40 | 0.46 | 0.80 | 0.35 | 0.70 | 0.54 | 0.88 | 1.05 | 1.04 | 1.28 | 1.43 | 1.49 | 1.44 | 1.77 | 1.32 | 1.78 | 1.83 | 1.48 | 0.89 | 0.73 | 1.09 | 0.75 | 1.27 | 1.47 | 1.49 | 1.75 | 1.53 | 0.86 | 1.32 | 1.53 | 0.37 | 0.42 | 0.27 | 0.22 | 0.33 | 0.26 | 0.30 | 0.69 | 0.30 | 0.84 | 0.69 | 0.43 | 1.53 | 2.97 | 3.04 | 3.06 | 1.16 |
| PIPES | ME917929 | 0.26 | 0.26 | 0.31 | 0.14 | 0.73 | 1.06 | 0.77 | 0.77 | 0.81 | 0.52 | 0.86 | 0.63 | 0.92 | 0.87 | 0.81 | 0.80 | 1.40 | 1.37 | 1.27 | 1.46 | 1.20 | 1.43 | 1.68 | 1.31 | 0.92 | 0.69 | 0.88 | 0.67 | 1.26 | 1.12 | 1.86 | 1.41 | 1.68 | 0.92 | 1.44 | 1.28 | 0.40 | 0.57 | 0.51 | 0.31 | 0.31 | 0.33 | 0.41 | 0.43 | 0.40 | 0.81 | 0.68 | 0.60 | 1.23 | 3.48 | 3.48 | 3.26 | 0.98 |
| PE(36:2) | ME917992 | 0.43 | 0.30 | 0.21 | 0.11 | 0.62 | 0.68 | 0.65 | 0.73 | 0.89 | 0.52 | 0.68 | 0.48 | 1.01 | 0.84 | 1.17 | 1.18 | 1.63 | 1.33 | 1.34 | 1.65 | 1.08 | 1.53 | 1.61 | 1.35 | 0.93 | 0.76 | 1.14 | 0.96 | 1.12 | 1.17 | 1.49 | 1.46 | 1.36 | 0.98 | 1.08 | 1.17 | 0.20 | 0.48 | 0.36 | 0.29 | 0.35 | 0.44 | 0.50 | 0.58 | 0.50 | 0.67 | 0.71 | 0.45 | 1.47 | 3.14 | 3.22 | 3.11 | 0.90 |
| O-Acetyl-L-serine | ME917703 | 0.64 | 0.40 | 0.40 | 0.22 | 0.55 | 0.81 | 0.43 | 0.57 | 0.62 | 0.44 | 0.59 | 0.38 | 1.26 | 1.08 | 1.22 | 1.15 | 1.58 | 1.52 | 1.49 | 1.40 | 1.36 | 1.36 | 1.37 | 1.30 | 1.14 | 0.81 | 1.07 | 1.07 | 1.22 | 1.20 | 1.56 | 1.21 | 1.24 | 0.74 | 0.95 | 1.09 | 0.32 | 0.54 | 0.41 | 0.28 | 0.34 | 0.50 | 0.63 | 0.60 | 0.37 | 0.63 | 0.70 | 0.41 | 1.57 | 3.58 | 3.36 | 3.33 | 0.97 |
| Secobarbital | ME917923 | 0.57 | 0.34 | 0.31 | 0.23 | 0.55 | 0.75 | 0.38 | 0.62 | 0.68 | 0.55 | 0.64 | 0.45 | 0.86 | 0.86 | 0.96 | 1.10 | 1.51 | 1.45 | 1.39 | 1.22 | 1.34 | 1.45 | 1.43 | 1.43 | 0.97 | 0.84 | 0.95 | 1.02 | 1.19 | 1.06 | 1.50 | 1.32 | 1.29 | 0.89 | 1.15 | 1.19 | 0.29 | 0.54 | 0.36 | 0.23 | 0.34 | 0.40 | 0.52 | 0.56 | 0.46 | 0.86 | 0.70 | 0.41 | 1.35 | 3.52 | 3.59 | 3.55 | 0.88 |
| CPX | ME917960 | 0.36 | 0.34 | 0.51 | 0.25 | 0.64 | 0.68 | 0.51 | 0.67 | 0.95 | 0.83 | 0.55 | 0.56 | 1.16 | 1.32 | 1.22 | 1.21 | 0.95 | 1.08 | 0.95 | 1.04 | 0.87 | 0.88 | 1.12 | 0.72 | 1.44 | 1.12 | 1.47 | 1.16 | 1.37 | 1.14 | 1.26 | 1.10 | 1.14 | 1.15 | 1.03 | 1.16 | 0.52 | 0.48 | 0.58 | 0.38 | 0.97 | 0.97 | 1.39 | 1.63 | 0.59 | 1.54 | 1.07 | 0.93 | 1.38 | 1.71 | 1.98 | 1.85 | 1.14 |
| Uracil | ME917781 | NA | NA | NA | NA | 0.43 | 0.58 | 0.40 | 0.68 | 1.00 | 0.81 | 0.98 | 0.46 | 1.06 | 0.98 | 1.25 | 1.71 | 1.42 | 1.52 | 1.12 | 1.39 | 1.37 | 0.97 | 0.92 | 1.08 | 1.14 | 0.84 | 1.36 | 1.26 | 0.83 | 1.15 | 1.28 | 1.14 | 1.07 | 0.98 | 1.02 | 0.85 | 0.41 | 0.54 | 0.48 | NA | 0.31 | 0.69 | 1.05 | 0.89 | 0.36 | 1.32 | 0.78 | 0.49 | 0.82 | 2.02 | 1.79 | 2.11 | 0.89 |
| ADP | ME917891 | 0.75 | 0.50 | 0.48 | 0.26 | 0.81 | 1.34 | 1.00 | 0.91 | 0.76 | 0.43 | 0.68 | 0.48 | 1.18 | 1.44 | 0.85 | 1.23 | 1.89 | 1.46 | 0.99 | 1.69 | 1.03 | 0.69 | 0.96 | 0.94 | 1.04 | 0.78 | 0.99 | 0.80 | 0.98 | 0.88 | 1.29 | 0.89 | 0.94 | 0.72 | 0.75 | 0.99 | 0.46 | 0.89 | 0.55 | 0.47 | 0.68 | 0.75 | 1.07 | 1.26 | 0.47 | 0.93 | 0.95 | 0.66 | 1.33 | 2.44 | 2.55 | 2.49 | 1.26 |
| Trp-Ser | ME917590 | 0.60 | 0.36 | 0.42 | 0.15 | 0.60 | 0.83 | 0.55 | 0.55 | 0.73 | 0.67 | 0.93 | 0.98 | 0.99 | 2.14 | 0.93 | 0.73 | 1.69 | 1.24 | 0.67 | 0.94 | 0.80 | 0.46 | 1.39 | 1.23 | 1.71 | 1.02 | 1.03 | 1.10 | 1.07 | 0.71 | 1.11 | 0.74 | 1.18 | 0.82 | 0.77 | 1.26 | 0.40 | 0.69 | 0.47 | 0.50 | 0.56 | 0.56 | 0.50 | 0.65 | 0.46 | 1.10 | 1.00 | 1.06 | 1.33 | 3.43 | 2.89 | 3.14 | 1.16 |
| Glycerophosphoglycerol | ME917872 | 1.54 | 0.89 | 1.05 | 0.71 | NA | 0.72 | NA | NA | NA | NA | NA | NA | 0.88 | NA | 0.44 | 0.76 | 1.16 | NA | NA | 0.78 | NA | 0.86 | 1.31 | 1.55 | 1.14 | 1.00 | 0.81 | 1.10 | 1.19 | NA | 0.73 | 0.63 | 1.38 | 0.73 | 0.70 | 0.92 | NA | 0.93 | NA | NA | 0.84 | 1.47 | 1.33 | 1.77 | NA | 0.79 | NA | 0.56 | 1.11 | 0.97 | 1.16 | 1.14 | 0.93 |
| NADP+ | ME917886 | 0.95 | NA | NA | NA | NA | 0.55 | NA | NA | NA | NA | 0.66 | NA | NA | NA | 0.29 | 0.94 | 1.56 | 0.52 | 1.31 | 1.49 | 1.24 | 0.78 | 1.40 | 1.55 | 1.25 | NA | 0.60 | 1.00 | 1.58 | 0.46 | 1.10 | 0.52 | 0.93 | 0.76 | 0.94 | 0.89 | NA | 0.39 | NA | NA | NA | 0.81 | 0.74 | 1.55 | NA | NA | NA | 0.30 | 2.39 | 1.05 | 1.26 | 1.27 | 0.97 |
| Glu-Ile-Val | ME917671 | NA | NA | NA | NA | NA | NA | NA | NA | 0.48 | NA | NA | NA | 0.46 | NA | NA | 1.10 | 1.87 | 1.24 | 1.25 | 0.50 | 0.67 | 1.01 | 1.19 | 1.18 | 1.01 | 1.04 | 1.05 | 1.07 | 1.20 | 0.52 | 1.68 | 0.92 | 1.31 | NA | 0.98 | 0.81 | NA | NA | NA | NA | NA | NA | 0.29 | NA | NA | NA | 0.33 | NA | 1.84 | 1.28 | 0.38 | 1.17 | 1.17 |
| 6-Acetamido-3-aminohexanoate | ME917704 | NA | NA | NA | NA | 0.55 | 0.60 | NA | NA | NA | NA | 0.71 | NA | 0.84 | 0.62 | 1.15 | 1.13 | 1.41 | 0.88 | 1.33 | 1.43 | NA | 0.49 | 0.99 | 1.16 | 1.42 | 0.66 | 0.96 | 1.50 | 1.47 | 0.98 | 1.55 | 1.02 | 1.18 | 0.53 | 0.79 | 0.91 | NA | 0.64 | 0.51 | NA | NA | 0.44 | NA | 0.55 | NA | NA | 0.47 | NA | 2.14 | 1.36 | 1.19 | 1.62 | 0.82 |
| PG(34:3) | ME917831 | NA | NA | NA | NA | NA | 0.67 | NA | NA | NA | NA | NA | NA | 0.86 | 0.52 | 0.82 | 1.13 | 1.11 | 0.91 | 1.25 | 1.40 | 1.25 | 0.77 | 1.14 | 1.57 | 0.74 | 0.35 | 1.11 | 0.94 | 0.90 | 1.32 | 0.96 | 1.01 | 1.29 | 0.52 | 0.82 | 1.01 | NA | NA | NA | NA | NA | NA | 0.35 | 0.39 | NA | NA | 0.33 | NA | 2.74 | 1.36 | 1.27 | 1.40 | 0.79 |
| N6-Acetyl-L-lysine | ME917711 | 0.85 | 0.52 | NA | NA | NA | 0.75 | NA | NA | 0.58 | NA | 0.65 | NA | 1.04 | 0.64 | 0.85 | 0.80 | 0.80 | NA | NA | 0.90 | NA | 0.52 | 1.01 | 0.84 | 0.94 | NA | 1.66 | 0.90 | 0.74 | 1.03 | 2.04 | 0.80 | 1.20 | 0.56 | 0.75 | 0.60 | NA | 1.57 | 0.49 | NA | NA | 0.75 | 0.66 | NA | NA | NA | NA | NA | 1.19 | 2.25 | 2.10 | 2.38 | 0.66 |
| Ile-Ala-Ile | ME917581 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.29 | 1.51 | 1.70 | 0.98 | 1.53 | 0.97 | 0.53 | 1.00 | NA | 0.79 | 0.88 | 0.79 | 1.89 | 1.18 | 1.08 | 0.98 | 0.89 | 0.83 | 0.83 | 0.98 | 0.20 | NA | NA | 0.23 | NA | NA | NA | NA | 0.60 | 0.24 | 0.71 | NA | NA | NA | NA | NA | 1.03 | 1.63 | 1.62 | 1.42 | 0.68 |
| Urate | ME917875 | NA | 0.41 | NA | NA | NA | NA | NA | NA | NA | NA | 0.70 | NA | 1.11 | 0.55 | 0.85 | 1.06 | 1.51 | NA | 0.73 | 0.81 | NA | 0.52 | 1.41 | 1.36 | 1.40 | 0.87 | 1.68 | 0.97 | 0.90 | 0.61 | 0.92 | 0.74 | 0.53 | NA | NA | 0.56 | NA | NA | NA | NA | NA | NA | NA | 0.65 | NA | NA | 0.42 | NA | 1.11 | 1.95 | 2.02 | 2.10 | 0.54 |
| FA hydroxy(18:0) | ME917860 | NA | NA | 1.25 | 1.32 | 1.00 | 0.28 | 1.12 | 0.61 | 1.00 | 1.02 | 0.13 | 1.75 | NA | 0.56 | 0.50 | NA | 1.03 | 1.30 | 0.57 | 1.41 | 1.30 | 1.38 | 0.67 | 0.72 | NA | 0.48 | 1.72 | 0.82 | 0.94 | 1.22 | 1.20 | 1.33 | 0.80 | NA | 0.44 | 0.60 | NA | 0.65 | NA | NA | 1.05 | 1.30 | 0.45 | 2.00 | 1.94 | 0.31 | NA | 1.52 | 1.86 | 0.74 | 0.84 | 0.86 | 1.00 |
| N-Formimino-L-glutamate | ME918016 | 0.57 | 0.52 | 0.35 | 0.73 | 0.53 | 0.77 | 1.15 | 0.69 | 1.76 | 1.31 | 0.85 | 1.34 | 0.65 | 0.59 | 1.53 | 0.50 | 0.97 | 1.75 | 2.11 | 1.66 | 1.72 | 2.01 | 1.10 | 0.94 | 0.36 | 0.38 | NA | 0.34 | 0.96 | 1.23 | 1.51 | 1.94 | 1.15 | 1.89 | 1.90 | 1.22 | 0.35 | 0.47 | 0.44 | 0.48 | NA | 0.72 | 0.32 | 0.67 | 2.58 | 0.89 | 0.72 | 0.66 | 2.51 | 1.03 | 1.18 | 1.16 | 0.78 |
| Xanthine | ME917934 | 0.14 | 0.04 | 0.10 | 0.04 | 0.14 | 0.23 | 0.26 | 0.20 | 0.29 | 0.20 | 0.33 | 0.13 | 0.63 | 0.73 | 1.42 | 2.34 | 2.38 | 3.73 | 3.04 | 2.83 | 1.85 | 1.30 | 1.67 | 1.43 | 0.96 | 0.61 | 2.05 | 2.00 | 1.56 | 2.16 | 3.83 | 2.29 | 1.01 | 0.56 | 1.11 | 1.35 | 0.04 | 0.06 | 0.11 | 0.04 | 0.10 | 0.19 | 0.37 | 0.85 | 0.10 | 0.62 | 0.31 | 0.14 | 0.70 | 1.11 | 1.15 | 1.33 | 0.87 |
| Asp-Leu-Pro-Pro | ME917956 | 0.04 | NA | NA | NA | 0.11 | 0.24 | 0.22 | 0.17 | 0.20 | 0.14 | 0.24 | 0.11 | 0.49 | 0.56 | 1.17 | 1.78 | 1.88 | 3.06 | 4.41 | 2.89 | 2.22 | 1.42 | 1.83 | 1.80 | 0.50 | 0.26 | 1.28 | 1.32 | 1.20 | 1.78 | 4.16 | 1.99 | 0.69 | 0.32 | 0.81 | 0.77 | NA | NA | 0.07 | NA | NA | 0.04 | 0.14 | 0.35 | 0.12 | 0.23 | 0.23 | 0.07 | 0.67 | 0.99 | 1.14 | 1.11 | 0.79 |
| PG(32:2) | ME917578 | NA | NA | NA | NA | 0.06 | 0.19 | 0.24 | 0.16 | 0.22 | 0.12 | 0.26 | 0.13 | 0.47 | 0.49 | 1.13 | 1.61 | 1.90 | 2.68 | 4.24 | 2.86 | 1.77 | 1.51 | 1.75 | 1.57 | 0.49 | 0.26 | 1.31 | 1.36 | 1.04 | 1.50 | 3.96 | 1.79 | 0.66 | 0.29 | 0.72 | 0.77 | NA | NA | NA | NA | NA | NA | 0.16 | 0.36 | 0.12 | 0.23 | 0.24 | 0.05 | 0.65 | 0.93 | 0.97 | 1.07 | 0.74 |
| L-Histidine | ME917865 | NA | NA | NA | NA | NA | 0.40 | 0.23 | 0.15 | 0.55 | 0.19 | 0.10 | 0.09 | 1.89 | 1.35 | 0.39 | 0.31 | 1.00 | 2.58 | 0.60 | 0.76 | 3.64 | 1.65 | 3.91 | 1.68 | 0.67 | 0.33 | 0.63 | 0.49 | 1.83 | 0.84 | 1.13 | 0.33 | 0.68 | 0.41 | 0.30 | 2.23 | NA | 0.08 | NA | NA | 0.13 | NA | NA | NA | NA | 0.36 | 0.42 | NA | 3.22 | 1.24 | 1.43 | 1.34 | 1.41 |
| 2-Dehydro-3-deoxy-D-glucarate | ME917600 | 0.52 | 0.13 | 0.37 | 0.06 | 0.15 | 1.24 | 1.02 | 0.34 | 0.68 | 0.11 | 0.15 | 0.09 | 2.58 | 3.14 | 0.70 | 0.51 | 2.68 | 4.87 | 0.81 | 1.59 | 3.27 | 0.57 | 2.38 | 1.61 | 1.59 | 0.60 | 0.78 | 1.17 | 2.14 | 1.82 | 2.72 | 0.36 | 0.41 | 0.36 | 0.23 | 1.65 | 0.25 | 0.51 | 0.20 | 0.33 | 0.20 | 0.21 | 0.24 | 0.18 | 0.09 | 0.38 | 0.31 | 0.10 | 2.08 | 2.36 | 2.41 | 2.39 | 2.30 |
| dTDP | ME917616 | NA | NA | NA | NA | 0.14 | 0.38 | 0.39 | 0.18 | 0.18 | 0.12 | 0.18 | NA | 1.12 | 1.53 | 0.76 | 0.79 | 2.05 | 3.99 | 1.33 | 1.31 | 2.75 | 1.11 | 1.65 | 0.89 | 1.20 | 0.70 | 0.85 | 0.71 | 1.78 | 1.20 | 1.89 | 0.90 | 0.75 | 0.56 | 0.80 | 1.39 | NA | 0.12 | 0.13 | NA | NA | NA | 0.13 | NA | NA | 0.59 | 0.22 | 0.18 | 1.22 | 1.49 | 1.58 | 1.36 | 1.39 |
| Trp-Ala | ME917928 | 0.21 | 0.15 | 0.09 | NA | 0.19 | 0.42 | 0.36 | 0.25 | 0.31 | 0.21 | 0.26 | 0.08 | 1.00 | 1.45 | 0.92 | 0.70 | 2.45 | 4.56 | 1.75 | 1.69 | 3.22 | 1.59 | 2.36 | 1.12 | 1.66 | 0.92 | 1.08 | 0.86 | 2.31 | 1.37 | 2.26 | 1.36 | 0.74 | 0.49 | 0.78 | 1.44 | 0.17 | 0.20 | 0.09 | 0.08 | 0.08 | 0.19 | 0.19 | 0.08 | 0.17 | 0.63 | 0.35 | 0.23 | 1.54 | 1.80 | 1.94 | 1.96 | 1.70 |
| dGDP | ME917557 | 0.40 | 0.21 | 0.48 | 0.26 | 0.46 | 0.48 | 0.44 | 0.45 | 0.53 | 0.49 | 0.48 | 0.51 | 0.69 | 0.61 | 0.73 | 0.76 | 3.00 | 3.16 | 2.00 | 2.07 | 4.62 | 4.11 | 3.39 | 3.13 | 0.63 | 0.49 | 0.74 | 0.69 | 0.91 | 0.89 | 1.30 | 0.76 | 1.58 | 1.00 | 1.64 | 1.53 | 0.30 | 0.36 | 0.41 | 0.34 | 0.33 | 0.47 | 0.38 | 0.61 | 0.22 | 0.53 | 0.50 | 0.35 | 1.14 | 1.50 | 1.52 | 1.45 | 1.19 |
| FA hydroxy(20:3) | ME917939 | 0.01 | NA | 0.02 | NA | 0.33 | 0.58 | 0.46 | 0.40 | 0.44 | 0.36 | 0.41 | 0.30 | 0.28 | 0.18 | 0.20 | 0.21 | 2.68 | 3.02 | 1.89 | 1.47 | 4.53 | 3.90 | 3.55 | 2.61 | 0.15 | 0.13 | 0.30 | 0.11 | 1.26 | 1.15 | 1.73 | 0.81 | 1.91 | 1.13 | 1.70 | 1.81 | 0.08 | 0.11 | 0.10 | 0.10 | NA | NA | NA | NA | 0.09 | 0.36 | 0.19 | 0.16 | 1.01 | 1.22 | 1.25 | 1.26 | 1.05 |
| Val-Tyr | ME917940 | 0.01 | NA | 0.02 | NA | 0.31 | 0.63 | 0.45 | 0.39 | 0.43 | 0.36 | 0.40 | 0.29 | 0.27 | 0.18 | 0.20 | 0.22 | 2.94 | 2.97 | 1.86 | 1.57 | 4.46 | 3.84 | 3.49 | 2.57 | 0.14 | 0.13 | 0.27 | 0.11 | 1.24 | 1.13 | 1.70 | 0.80 | 1.87 | 1.11 | 1.81 | 1.93 | 0.08 | 0.11 | 0.10 | 0.10 | NA | NA | NA | NA | 0.09 | 0.36 | 0.18 | 0.18 | 1.00 | 1.20 | 1.23 | 1.24 | 1.03 |
| Decanoic acid | ME917687 | NA | NA | NA | NA | 0.35 | 0.70 | 0.44 | 0.37 | 0.51 | 0.43 | 0.55 | 0.33 | 1.21 | 0.96 | 0.95 | 1.15 | 2.54 | 2.38 | 3.37 | 2.42 | 2.93 | 3.00 | 2.84 | 2.05 | 0.63 | 0.36 | 0.73 | 0.59 | 0.98 | 1.12 | 1.36 | 0.96 | 1.29 | 0.66 | 0.98 | 0.79 | 0.21 | 0.33 | 0.31 | 0.26 | NA | 0.13 | 0.15 | 0.19 | 0.27 | 0.43 | 0.35 | 0.24 | 0.43 | 1.28 | 1.22 | 1.24 | 1.04 |
| FA(16:0) | ME917650 | 0.18 | 0.11 | 0.18 | 0.07 | 0.23 | 0.34 | 0.34 | 0.28 | 0.37 | 0.27 | 0.42 | 0.29 | 1.09 | 1.05 | 1.48 | 1.48 | 2.06 | 2.72 | 2.49 | 1.99 | 2.87 | 2.16 | 4.52 | 2.73 | 0.76 | 0.51 | 0.98 | 0.85 | 0.76 | 0.64 | 1.41 | 1.01 | 1.16 | 0.61 | 1.85 | 1.93 | 0.11 | 0.19 | 0.18 | 0.15 | 0.14 | 0.19 | 0.33 | 0.31 | 0.16 | 0.63 | 0.52 | 0.31 | 1.28 | 1.77 | 1.72 | 1.66 | 1.14 |
| Cytidine | ME918003 | 0.04 | 0.04 | 0.05 | 0.03 | 0.45 | 0.59 | 0.40 | 0.52 | 0.60 | 0.47 | 0.58 | 0.32 | 1.31 | 1.10 | 0.92 | 1.12 | 1.58 | 2.24 | 2.81 | 2.45 | 2.66 | 2.93 | 2.77 | 1.89 | 0.66 | 0.39 | 0.70 | 0.64 | 0.95 | 0.97 | 1.43 | 1.04 | 1.09 | 0.68 | 1.04 | 0.95 | 0.31 | 0.35 | 0.38 | 0.30 | 0.12 | 0.13 | 0.18 | 0.27 | 0.22 | 0.41 | 0.36 | 0.22 | 3.80 | 2.17 | 2.16 | 2.00 | 1.20 |
| FA oxo(16:0) | ME917749 | NA | NA | NA | 0.11 | NA | 0.15 | NA | NA | 0.14 | 0.16 | 0.37 | 0.14 | 0.74 | 0.44 | 0.86 | 0.76 | 1.78 | 1.01 | 2.26 | 1.27 | 2.27 | 3.97 | 2.37 | 1.87 | 0.31 | 0.21 | 0.58 | 0.43 | 0.36 | 0.35 | 0.98 | 0.89 | 0.99 | 0.30 | 1.39 | 0.89 | NA | 0.11 | 0.12 | 0.12 | NA | 0.12 | NA | NA | NA | NA | 0.11 | NA | 1.84 | 3.07 | 3.13 | 3.35 | 0.60 |
| trans-Aconitate | ME917712 | NA | NA | NA | 0.11 | NA | 0.15 | NA | NA | 0.14 | 0.16 | 0.37 | 0.14 | 0.73 | 0.48 | 0.74 | 0.77 | 1.55 | 1.30 | 1.61 | 1.19 | 2.31 | 4.03 | 2.41 | 1.90 | 0.32 | 0.21 | 0.59 | 0.44 | 0.36 | 0.35 | 0.99 | 0.90 | 1.07 | 0.26 | 0.95 | 0.77 | NA | 0.11 | 0.12 | NA | NA | 0.08 | NA | NA | NA | NA | 0.11 | NA | 1.87 | 3.12 | 3.17 | 3.40 | 0.61 |
| Scytalone | ME917818 | NA | NA | NA | NA | 0.32 | 0.31 | NA | 0.58 | 0.39 | 1.44 | 0.28 | NA | NA | NA | NA | NA | 0.24 | 0.44 | 1.02 | 0.51 | 0.36 | 0.57 | 0.62 | 0.61 | NA | 0.77 | 2.22 | NA | 0.33 | 2.59 | 1.54 | 1.81 | 0.70 | 1.05 | 0.58 | 0.75 | 0.39 | 0.19 | 1.12 | 4.90 | NA | NA | NA | 1.82 | NA | 0.25 | 0.76 | NA | 2.14 | 1.02 | 0.89 | 1.24 | 1.25 |
| 3,4-Dihydroxybenzoate | ME917702 | 0.43 | 0.80 | 0.20 | 0.73 | 0.79 | 0.54 | 0.37 | 0.46 | 0.32 | 1.33 | 0.45 | 0.44 | 1.68 | 1.81 | 1.42 | 0.52 | 0.43 | 0.56 | 1.99 | 0.90 | 1.01 | 0.50 | 1.11 | 1.06 | 0.54 | 1.83 | 2.04 | 0.65 | 0.50 | 1.70 | 1.60 | 1.25 | 1.13 | 1.50 | 0.37 | 1.20 | 0.56 | 0.33 | 1.15 | 3.45 | 1.24 | 0.25 | 0.38 | 2.37 | 1.47 | 0.42 | 0.89 | 0.46 | 3.32 | 1.55 | 1.50 | 1.36 | 0.88 |
| Suberic acid | ME917803 | 0.26 | 1.18 | 0.30 | 0.74 | 0.99 | 0.49 | 0.74 | 0.92 | 0.49 | 1.06 | 0.52 | 0.37 | 1.51 | 1.45 | 0.51 | 0.61 | 0.26 | 0.28 | 0.82 | 0.54 | 1.18 | 0.33 | 1.33 | 1.32 | 0.12 | 1.69 | 2.08 | 0.78 | 0.39 | 2.02 | 1.74 | 1.43 | 1.11 | 1.43 | 0.37 | 1.23 | 0.52 | 0.50 | 1.37 | 2.61 | 1.59 | 0.27 | 0.19 | 2.78 | 1.59 | 0.32 | 1.05 | 0.93 | 2.48 | 1.00 | 1.11 | 1.03 | 1.08 |
| FA (17:0) | ME917701 | 0.30 | 1.17 | 0.68 | 2.63 | 0.32 | 1.76 | 1.26 | 0.32 | 1.94 | 1.50 | 0.45 | 0.52 | 0.48 | 0.57 | 2.93 | NA | 0.64 | 0.59 | 2.26 | 0.33 | 0.38 | 1.56 | 0.73 | 0.86 | 0.90 | 0.42 | 0.73 | 1.31 | 1.52 | 0.37 | 1.19 | 1.50 | 0.45 | 1.10 | 0.72 | 0.97 | 0.40 | 0.47 | 0.38 | 2.17 | 3.19 | 0.60 | 0.30 | 1.26 | 1.50 | 0.46 | 0.43 | 0.61 | 2.55 | 1.41 | 1.27 | 1.12 | 1.18 |
| Rishitin | ME917785 | 0.92 | 0.63 | 0.44 | 3.06 | 0.62 | 0.84 | 1.69 | 0.50 | 0.57 | 0.85 | 0.39 | 0.84 | 1.89 | 1.19 | 1.40 | 0.33 | 0.39 | 0.69 | 1.29 | 0.16 | 1.08 | 1.77 | 1.05 | 2.84 | 0.61 | 0.26 | 0.87 | 1.28 | 0.53 | 1.34 | 0.63 | 2.33 | 0.97 | 0.52 | 2.82 | 1.00 | 0.40 | 0.49 | 0.64 | 1.56 | 1.45 | 0.71 | 0.79 | 0.60 | 1.81 | 0.52 | 1.34 | 0.49 | 3.29 | 0.71 | 0.84 | 0.74 | 1.56 |
| BPH-674 | ME917836 | 1.46 | NA | NA | 1.02 | NA | 0.35 | NA | NA | NA | 0.45 | NA | 0.79 | NA | 0.46 | 1.32 | NA | 1.20 | NA | NA | NA | NA | 0.66 | 0.42 | 1.28 | 0.93 | NA | NA | NA | 1.05 | 0.39 | 0.61 | 0.37 | NA | 0.90 | 1.04 | 0.70 | NA | 1.19 | NA | 0.77 | NA | NA | NA | NA | 1.46 | 1.21 | 0.40 | 0.86 | 4.01 | 0.92 | 1.21 | 1.33 | 1.23 |
| Glycyl-leucine | ME917734 | 1.01 | 0.72 | 0.73 | 0.65 | NA | 1.92 | NA | 0.51 | 0.79 | 0.60 | 0.57 | 0.45 | 0.63 | 0.75 | 1.43 | NA | 0.71 | 2.34 | NA | 0.70 | NA | 0.50 | 1.23 | 0.61 | 0.44 | 0.50 | 0.56 | 0.54 | 0.58 | 0.73 | 0.64 | 0.81 | 0.61 | 2.14 | 0.60 | 0.53 | 0.52 | 0.65 | 0.46 | 0.68 | 1.94 | 0.65 | 0.82 | 0.98 | NA | 0.70 | 1.48 | 0.81 | 5.09 | 1.29 | 1.82 | 1.88 | 1.72 |
| Phosphoenolpyruvate | ME917918 | 0.91 | 0.91 | 0.66 | 1.55 | 0.77 | 0.86 | 0.81 | 0.46 | 0.65 | 0.52 | 0.36 | 0.61 | 1.19 | 1.33 | 1.25 | 0.80 | 0.79 | 1.16 | 1.48 | 0.78 | 0.77 | 0.98 | 0.83 | 0.55 | 1.38 | 1.61 | 1.13 | 0.97 | 0.58 | 0.67 | 0.77 | 0.93 | 0.50 | 0.72 | 0.48 | 0.66 | 0.47 | 0.48 | 0.37 | 0.60 | 0.99 | 1.02 | 1.03 | 1.89 | 1.09 | 0.60 | 1.47 | 0.70 | 6.33 | 2.46 | 2.01 | 2.12 | 1.90 |
| Serinyl-Serine | ME917792 | 1.01 | 0.73 | 0.83 | 1.05 | 0.53 | 1.05 | 0.83 | 0.67 | 0.67 | 0.54 | 0.43 | 0.65 | 0.82 | 0.65 | 0.82 | 0.82 | 0.67 | 1.20 | 0.54 | 0.82 | 0.79 | 0.54 | 0.51 | 0.78 | 1.42 | 1.66 | 1.17 | 1.00 | 0.80 | 0.86 | 1.01 | 0.56 | 0.69 | 0.89 | 0.49 | 0.81 | 0.42 | 0.59 | 0.43 | 0.43 | 1.13 | 1.19 | 1.49 | 2.43 | 1.12 | 0.70 | 1.09 | 0.92 | 6.53 | 2.54 | 2.07 | 2.19 | 2.03 |
| Valyl-Phenylalanine | ME917900 | 0.44 | 0.26 | NA | NA | 0.62 | 1.26 | 0.46 | 0.73 | 0.75 | 0.44 | 0.85 | 0.41 | 0.96 | 0.63 | 0.95 | 1.61 | 1.40 | 0.71 | 0.99 | 1.74 | 0.75 | 0.42 | 0.96 | 1.34 | 1.69 | 1.02 | 1.26 | 1.77 | 0.85 | 0.67 | 1.47 | 0.78 | 0.89 | 0.63 | 0.74 | 0.90 | 0.54 | 1.19 | 0.70 | 0.37 | 0.18 | 0.39 | 0.58 | 0.84 | NA | 0.28 | 0.37 | 0.22 | 6.27 | 1.59 | 1.94 | 1.83 | 1.38 |
| L-gamma-glutamyl-L-isoleucine | ME917743 | 0.53 | 0.34 | 0.36 | 0.22 | 0.57 | 0.84 | 0.44 | 0.50 | 0.73 | 0.62 | 0.70 | 0.41 | 0.83 | 0.73 | 0.82 | 1.11 | 1.47 | 1.55 | 1.49 | 1.38 | 1.38 | 1.24 | 1.52 | 1.51 | 0.82 | 0.81 | 0.92 | 1.00 | 1.26 | 1.13 | 1.40 | 1.19 | 1.40 | 0.96 | 1.16 | 1.28 | 0.19 | 0.63 | 0.37 | 0.27 | 0.37 | 0.42 | 0.54 | 0.63 | 0.43 | 0.75 | 0.63 | 0.55 | 7.41 | 1.43 | 1.35 | 1.46 | 0.93 |
| Uridine | ME917927 | 0.78 | 0.58 | 0.85 | 1.02 | 0.73 | 1.16 | 0.84 | 0.82 | 0.76 | 0.70 | 0.80 | 0.89 | 1.34 | 1.12 | 0.68 | 0.66 | 1.11 | 1.19 | 1.51 | 1.16 | 1.03 | 0.82 | 0.82 | 0.83 | 0.90 | 0.63 | 0.78 | 0.79 | 1.11 | 1.13 | 1.48 | 0.80 | 1.12 | 0.85 | 1.09 | 0.89 | 0.76 | 0.63 | 0.74 | 1.12 | 0.63 | 0.58 | 0.57 | 1.32 | 1.54 | 1.25 | 0.83 | 0.86 | 7.30 | 0.97 | 1.05 | 1.15 | 1.42 |
| Alanyl-Tryptophan | ME917776 | 0.74 | 0.64 | 0.30 | 3.35 | 0.94 | 0.95 | 1.11 | 0.38 | 0.45 | 0.48 | 0.52 | 0.88 | 1.38 | 1.26 | 2.22 | 0.75 | 0.48 | 0.64 | 1.31 | 0.87 | 0.69 | 0.72 | 0.45 | 0.50 | 0.36 | 0.96 | 1.10 | 0.62 | 0.86 | 1.03 | 1.77 | 2.72 | 0.66 | 0.98 | 0.85 | 0.99 | 0.21 | 0.22 | 0.41 | 1.07 | 0.65 | 0.64 | 0.27 | 1.47 | 3.95 | 1.19 | 1.63 | 0.59 | 3.28 | 1.23 | 1.30 | 1.39 | 1.56 |
| FA (8:1) octenal | ME917771 | 0.81 | 0.66 | 0.54 | 2.48 | 0.81 | 1.25 | 1.06 | 0.59 | 0.49 | 0.69 | 0.46 | 0.75 | 1.05 | 0.98 | 1.82 | 0.62 | 0.53 | 1.32 | 2.64 | 0.49 | 0.81 | 0.90 | 0.68 | 0.54 | 0.73 | 0.62 | 0.64 | 0.54 | 1.16 | 0.94 | 1.65 | 2.05 | 0.65 | 1.10 | 0.75 | 1.04 | 0.23 | 0.27 | 0.47 | 1.10 | 0.62 | 0.75 | 0.20 | 0.92 | 3.00 | 0.88 | 0.54 | 0.66 | 4.22 | 1.83 | 1.76 | 1.89 | 2.20 |
| 2-Acetolactate | ME917738 | 0.32 | 0.90 | 0.32 | 2.66 | 0.77 | 0.82 | 1.06 | 0.50 | 0.59 | 0.66 | 0.47 | 1.06 | 1.73 | 1.48 | 2.97 | 1.27 | 0.31 | 0.71 | 1.94 | 0.68 | 0.57 | 1.00 | 0.79 | 0.51 | 0.41 | 1.22 | 1.39 | 0.77 | 0.53 | 0.92 | 1.26 | 1.37 | 0.58 | 0.96 | 0.61 | 0.80 | 0.25 | 0.30 | 0.54 | 1.41 | 1.02 | 0.65 | 0.14 | 1.85 | 2.65 | 0.63 | 1.00 | 0.59 | 3.39 | 1.72 | 1.69 | 1.85 | 2.17 |
| 3-(4-Hydroxyphenyl)lactate | ME917715 | 0.67 | 0.82 | 0.57 | 3.79 | 0.59 | 0.79 | 1.15 | 0.54 | 0.69 | 0.75 | 0.54 | 0.76 | 1.38 | 1.15 | 2.23 | 0.88 | 0.65 | 1.07 | 1.46 | 0.66 | 0.69 | 0.90 | 0.78 | 0.52 | 0.66 | 1.12 | 1.21 | 0.73 | 0.68 | 0.79 | 1.27 | 1.52 | 0.70 | 0.98 | 0.61 | 0.85 | 0.41 | 0.43 | 0.59 | 0.98 | 1.03 | 0.82 | 0.54 | 1.58 | 1.73 | 0.76 | 0.89 | 0.70 | 4.92 | 1.51 | 0.69 | 1.76 | 1.75 |
| Nonate | ME917710 | 0.70 | 0.89 | 0.52 | 3.44 | 0.62 | 0.79 | 1.27 | 0.41 | 0.46 | 0.84 | 0.43 | 0.75 | 1.45 | 1.57 | 2.75 | 0.95 | 0.55 | 0.98 | 1.33 | 0.60 | 0.66 | 0.68 | 0.78 | 0.42 | 0.61 | 1.19 | 0.96 | 0.94 | 0.77 | 0.77 | 1.00 | 1.32 | 0.59 | 0.93 | 0.54 | 0.91 | 0.29 | 0.36 | 0.49 | 0.85 | 0.94 | 0.94 | 0.39 | 1.80 | 2.05 | 0.80 | 0.93 | 0.70 | 4.42 | 1.84 | 1.77 | 1.64 | 2.04 |
| 5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline | ME917722 | 3.28 | 1.36 | 1.91 | 0.97 | 1.17 | 1.76 | 0.89 | 1.34 | 1.53 | 0.90 | 1.26 | 0.95 | 0.64 | 0.44 | 0.33 | 0.74 | 0.99 | 0.94 | 0.67 | 0.65 | 0.92 | 0.63 | 0.75 | 0.83 | 0.61 | 0.60 | 0.53 | 0.64 | 0.71 | 0.50 | 0.68 | 0.35 | 1.41 | 1.50 | 1.18 | 1.09 | 0.76 | 1.52 | 0.68 | 0.81 | 0.93 | 1.02 | 1.09 | 3.33 | 1.05 | 1.40 | 1.14 | 1.54 | 2.20 | 1.09 | 0.98 | 1.19 | 1.08 |
| (2S)-2-Isopropyl-3-oxosuccinate | ME917790 | 1.35 | 0.56 | 0.41 | 1.42 | 0.32 | 1.00 | 0.86 | 0.34 | 0.97 | 1.21 | 0.94 | 0.68 | 2.67 | 2.08 | 1.86 | 1.40 | 1.16 | 0.92 | 1.01 | 0.59 | 0.48 | 0.95 | 0.40 | 1.23 | 1.42 | 1.10 | 0.94 | 0.94 | 0.90 | 0.34 | 0.53 | 0.72 | 0.98 | 0.78 | 0.54 | 0.89 | 0.38 | 0.78 | 0.71 | 1.02 | 0.67 | 0.78 | 0.81 | 2.08 | 1.71 | 1.12 | 0.97 | 0.90 | 4.34 | 0.93 | 1.22 | 1.10 | 1.41 |
| dADP | ME917913 | 2.27 | 1.73 | 1.56 | 1.47 | 1.25 | 1.44 | 1.25 | 1.15 | 1.69 | 1.07 | 1.11 | 1.11 | 0.76 | 0.59 | 0.49 | 0.84 | 0.80 | 1.27 | 1.08 | 0.75 | 0.70 | 0.81 | 0.86 | 0.60 | 0.57 | 0.71 | 0.70 | 0.59 | 0.62 | 0.54 | 0.70 | 0.49 | 1.27 | 1.33 | 0.94 | 1.06 | 0.76 | 1.27 | 0.74 | 1.21 | 0.89 | 0.92 | 0.95 | 1.90 | 1.50 | 1.25 | 1.28 | 0.94 | 3.68 | 0.97 | 0.98 | 1.05 | 0.99 |
| gamma-L-Glutamyl-L-cysteine | ME917908 | 1.86 | 1.36 | 1.34 | 0.81 | 1.12 | 1.27 | 0.94 | 1.22 | 1.88 | 0.91 | 1.08 | 0.87 | 0.80 | 0.48 | 0.52 | 0.75 | 0.84 | 1.04 | 0.91 | 0.83 | 0.62 | 0.66 | 0.67 | 0.61 | 0.52 | 0.74 | 0.65 | 0.60 | 0.59 | 0.56 | 0.83 | 0.56 | 1.05 | 1.27 | 0.80 | 0.89 | 0.74 | 1.07 | 0.60 | 0.70 | 0.82 | 0.87 | 0.80 | 2.01 | 0.95 | 1.30 | 1.29 | 0.90 | 4.44 | 0.96 | 1.12 | 1.08 | 0.90 |
| N-Acetylglutamine | ME917775 | 1.94 | 0.89 | 0.84 | 1.25 | 0.99 | 1.27 | 0.46 | 0.69 | 0.97 | 1.52 | 0.79 | 0.96 | 0.68 | 0.51 | 1.74 | 0.84 | 0.85 | 0.51 | 0.59 | 0.84 | 0.56 | 0.73 | 0.74 | 1.40 | 0.72 | 0.71 | 0.42 | 0.85 | 1.75 | 0.77 | 0.96 | 1.06 | 0.83 | 0.95 | 1.30 | 1.02 | 0.96 | 1.46 | 0.56 | 0.78 | 0.98 | 0.94 | 0.75 | 1.67 | 1.24 | 0.98 | 0.79 | 0.80 | 3.41 | 1.37 | 1.24 | 1.83 | 2.10 |
| FA hydroxy(7:0) | ME917678 | 1.17 | 0.74 | 1.10 | 1.02 | 0.80 | 1.21 | 0.93 | 1.28 | 0.74 | 1.03 | 0.84 | 0.98 | 1.04 | 0.94 | 0.80 | 0.77 | 1.22 | 0.58 | 0.56 | 0.63 | 0.65 | 0.65 | 1.31 | 1.24 | 1.00 | 0.72 | 0.59 | 0.91 | 1.41 | 0.90 | 0.72 | 0.84 | 0.86 | 1.22 | 1.06 | 1.04 | 0.96 | 1.27 | 0.95 | 1.44 | 0.40 | 1.05 | 0.82 | 1.67 | 1.45 | 0.87 | 0.91 | 1.10 | 4.10 | 1.33 | 1.34 | 1.26 | 1.56 |
| Galipine | ME917695 | 1.14 | 0.99 | 1.08 | 0.77 | 0.92 | 1.00 | 0.85 | 1.13 | 0.98 | 0.87 | 1.01 | 0.93 | 0.80 | 0.75 | 0.86 | 0.99 | 1.07 | 0.76 | 0.76 | 0.92 | 1.09 | 0.89 | 0.95 | 1.00 | 0.93 | 0.85 | 0.80 | 0.99 | 1.06 | 0.94 | 0.95 | 0.83 | 0.97 | 1.09 | 1.09 | 0.99 | 1.02 | 1.04 | 0.98 | 0.83 | 1.13 | 1.05 | 0.98 | 1.18 | 0.80 | 0.98 | 0.98 | 1.05 | 4.13 | 1.06 | 0.98 | 1.01 | 1.12 |
| Sedoheptulose | ME917735 | 0.62 | 1.00 | 1.27 | 1.01 | 0.69 | 1.15 | 0.88 | 0.49 | 0.64 | 1.69 | 1.15 | 1.08 | 1.82 | 0.97 | 1.48 | 0.92 | 0.93 | 0.68 | 1.14 | 0.57 | 0.65 | 0.60 | 0.59 | 0.73 | 1.48 | NA | 0.43 | 0.71 | 1.14 | 0.55 | 0.89 | 1.07 | 0.64 | 1.11 | 1.15 | 1.00 | 0.69 | 1.01 | 0.43 | 1.41 | 0.59 | 1.02 | 0.37 | 1.88 | 0.71 | 0.59 | 1.11 | 0.61 | 3.63 | 1.53 | 1.61 | 2.00 | 1.87 |
| Subaphyllin | ME917914 | 1.21 | 0.76 | 0.74 | 1.57 | 0.61 | 0.96 | 1.32 | 0.72 | 0.92 | 1.90 | 0.68 | 0.83 | 1.19 | 1.03 | 3.15 | 0.50 | 0.78 | 0.91 | 1.14 | 0.58 | 0.84 | 1.13 | 0.80 | 0.73 | 0.86 | 0.79 | 0.44 | 0.74 | 1.18 | 1.01 | 0.86 | 1.52 | 0.67 | 0.69 | 1.15 | 0.82 | 0.94 | 0.90 | 0.68 | 1.10 | 0.97 | 0.68 | 0.84 | 0.83 | 1.07 | 0.84 | 0.73 | 0.65 | 3.97 | 1.21 | 1.47 | 1.37 | 1.54 |
Factors:
| F1 | Sample source:Combination_1h | raw file name:COM_1h_1 |
| F2 | Sample source:Combination_1h | raw file name:COM_1h_2 |
| F3 | Sample source:Combination_1h | raw file name:COM_1h_3 |
| F4 | Sample source:Combination_1h | raw file name:COM_1h_4 |
| F5 | Sample source:Combination_3h | raw file name:COM_3h_1 |
| F6 | Sample source:Combination_3h | raw file name:COM_3h_2 |
| F7 | Sample source:Combination_3h | raw file name:COM_3h_3 |
| F8 | Sample source:Combination_3h | raw file name:COM_3h_4 |
| F9 | Sample source:Combination_6h | raw file name:COM_6h_1 |
| F10 | Sample source:Combination_6h | raw file name:COM_6h_2 |
| F11 | Sample source:Combination_6h | raw file name:COM_6h_3 |
| F12 | Sample source:Combination_6h | raw file name:COM_6h_4 |
| F13 | Sample source:Control_1h | raw file name:Control_1h_1 |
| F14 | Sample source:Control_1h | raw file name:Control_1h_2 |
| F15 | Sample source:Control_1h | raw file name:Control_1h_3 |
| F16 | Sample source:Control_1h | raw file name:Control_1h_4 |
| F17 | Sample source:Control_3h | raw file name:Control_3h_1 |
| F18 | Sample source:Control_3h | raw file name:Control_3h_2 |
| F19 | Sample source:Control_3h | raw file name:Control_3h_3 |
| F20 | Sample source:Control_3h | raw file name:Control_3h_4 |
| F21 | Sample source:Control_6h | raw file name:Control_6h_1 |
| F22 | Sample source:Control_6h | raw file name:Control_6h_2 |
| F23 | Sample source:Control_6h | raw file name:Control_6h_3 |
| F24 | Sample source:Control_6h | raw file name:Control_6h_4 |
| F25 | Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_1 |
| F26 | Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_2 |
| F27 | Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_3 |
| F28 | Sample source:Leu10-teixobactin_1h | raw file name:TX_1h_4 |
| F29 | Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_1 |
| F30 | Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_2 |
| F31 | Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_3 |
| F32 | Sample source:Leu10-teixobactin_3h | raw file name:TX_3h_4 |
| F33 | Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_1 |
| F34 | Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_2 |
| F35 | Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_3 |
| F36 | Sample source:Leu10-teixobactin_6h | raw file name:TX_6h_4 |
| F37 | Sample source:Polymyxin B_1h | raw file name:PMB_1h_1 |
| F38 | Sample source:Polymyxin B_1h | raw file name:PMB_1h_2 |
| F39 | Sample source:Polymyxin B_1h | raw file name:PMB_1h_3 |
| F40 | Sample source:Polymyxin B_1h | raw file name:PMB_1h_4 |
| F41 | Sample source:Polymyxin B_3h | raw file name:PMB_3h_1 |
| F42 | Sample source:Polymyxin B_3h | raw file name:PMB_3h_2 |
| F43 | Sample source:Polymyxin B_3h | raw file name:PMB_3h_3 |
| F44 | Sample source:Polymyxin B_3h | raw file name:PMB_3h_4 |
| F45 | Sample source:Polymyxin B_6h | raw file name:PMB_6h_1 |
| F46 | Sample source:Polymyxin B_6h | raw file name:PMB_6h_2 |
| F47 | Sample source:Polymyxin B_6h | raw file name:PMB_6h_3 |
| F48 | Sample source:Polymyxin B_6h | raw file name:PMB_6h_4 |
| F49 | Sample source:Pooled QC | raw file name:QC_1 |
| F50 | Sample source:Pooled QC | raw file name:QC_2 |
| F51 | Sample source:Pooled QC | raw file name:QC_3 |
| F52 | Sample source:Pooled QC | raw file name:QC_4 |
| F53 | Sample source:Pooled QC | raw file name:QC_5 |