Clustering data with hclust algorithm for (Study ST001683)
(Analysis AN002747)| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ELAIDIC ACID, OLEIC ACID, PETROSELINIC ACID | ME392302 | 0.03 | 0.47 | 0.04 | 0.04 | 0.38 | 0.02 | 0.04 | 0.05 | 0.02 | NA | NA | NA | 16.10 | 0.02 | 16.79 | 0.05 | 0.20 | 0.18 | 0.39 | 0.28 | 0.36 | 0.34 | 0.51 | NA | NA | NA | 0.03 | 0.07 | 0.08 | NA | NA | NA | 0.21 | 4.43 | 0.22 | 0.23 | 3.34 | 0.15 | 0.04 | 0.02 | 0.09 | NA | NA | NA |
| HYPOXANTHINE | ME392335 | 0.28 | 0.79 | 0.16 | 0.19 | 0.60 | 0.15 | 0.02 | 0.07 | 0.07 | NA | NA | NA | 19.55 | 0.55 | 14.98 | 0.37 | 1.26 | 0.24 | 0.05 | 0.10 | NA | NA | NA | 0.18 | 1.12 | 0.23 | NA | NA | NA | NA | NA | NA | 0.37 | 0.89 | 0.57 | 0.13 | 0.74 | 0.33 | 0.15 | 0.25 | 0.01 | 0.04 | 0.04 | 0.06 |
| URACIL | ME392459 | 0.41 | 0.58 | 0.01 | 0.16 | 0.35 | 0.06 | NA | NA | NA | 0.38 | 0.61 | 0.36 | 0.92 | 0.18 | 2.17 | 0.08 | 11.13 | 12.59 | NA | NA | NA | NA | NA | 1.02 | 0.20 | 1.00 | NA | NA | NA | 0.43 | 0.23 | 0.18 | 0.69 | 0.13 | 0.11 | 0.56 | 0.09 | 0.09 | NA | NA | NA | 0.14 | 0.22 | 0.23 |
| INDOLEPROPIONIC ACID | ME392341 | 0.00 | 0.15 | 0.00 | NA | 0.11 | NA | 0.01 | 3.32 | 0.01 | NA | NA | NA | 0.11 | 0.01 | 0.03 | 0.00 | NA | NA | 0.01 | 0.06 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.00 | 2.22 | 0.00 | 0.00 | 1.57 | 0.00 | 0.01 | 12.77 | 0.01 | NA | NA | NA |
| 4-GUANIDINOBUTANOIC ACID | ME392210 | 0.08 | 0.09 | 0.34 | 0.07 | 0.07 | 0.27 | NA | NA | NA | 0.77 | 0.78 | 0.77 | 0.12 | 0.37 | 0.15 | 0.31 | NA | NA | NA | NA | 0.18 | 0.12 | 0.21 | 0.62 | 0.23 | 0.48 | 0.18 | 0.25 | 0.18 | 6.62 | 14.01 | 4.35 | 0.39 | 0.31 | 0.48 | 0.27 | 0.24 | 0.38 | NA | NA | NA | 0.44 | 0.43 | 0.58 |
| UROCANIC ACID | ME392461 | 0.14 | 0.21 | 0.03 | 0.18 | 0.22 | 0.03 | NA | NA | NA | 0.31 | 0.26 | 0.31 | 0.03 | 0.10 | 0.03 | 0.09 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.29 | 0.23 | 0.24 | 6.66 | 9.11 | 4.93 | 0.96 | 0.23 | 0.15 | 1.05 | 0.20 | 0.12 | NA | NA | NA | 0.24 | 0.24 | 0.27 |
| N-ALPHA-ACETYL-ASPARAGINE | ME392376 | 0.36 | 0.56 | 0.02 | 0.61 | 0.84 | 0.02 | NA | NA | NA | NA | NA | NA | 3.60 | 0.09 | 10.06 | 0.23 | NA | NA | 0.61 | 0.14 | 0.34 | 2.36 | 0.48 | 0.43 | 1.35 | 0.43 | NA | NA | NA | NA | NA | NA | 3.33 | 0.06 | 0.01 | 3.05 | 0.05 | 0.19 | NA | NA | NA | 0.19 | 0.18 | 0.22 |
| CITRULLINE | ME392279 | 1.37 | 1.95 | 0.14 | 0.59 | 1.54 | 0.10 | 0.16 | 0.16 | 0.21 | NA | NA | NA | 9.46 | 0.51 | 10.11 | 0.38 | 0.29 | 0.39 | 0.03 | 0.04 | 1.47 | 0.75 | 0.96 | 1.54 | 0.87 | 1.07 | 1.39 | 0.97 | 1.37 | NA | NA | NA | 0.13 | 0.17 | 0.56 | 0.17 | 0.03 | 0.40 | 0.28 | 0.22 | 0.30 | 0.06 | 0.07 | 0.08 |
| NICOTINIC ACID, PICOLINIC ACID | ME392390 | 1.09 | 1.45 | 0.20 | 0.54 | 0.86 | 0.08 | NA | NA | NA | NA | NA | NA | 6.49 | 0.18 | 8.81 | 0.07 | NA | NA | NA | NA | 1.41 | 1.41 | 0.09 | 0.80 | 0.50 | 0.04 | NA | NA | NA | NA | NA | NA | 0.25 | 1.29 | 0.21 | 0.08 | 0.77 | 0.03 | NA | NA | NA | NA | NA | NA |
| KYNURENIC ACID | ME392346 | 0.08 | 0.13 | 0.02 | 0.09 | 0.16 | 0.02 | 0.07 | 0.05 | 0.10 | 1.10 | 1.29 | 1.15 | NA | NA | NA | NA | 0.26 | 0.45 | 7.79 | 10.06 | NA | NA | NA | NA | NA | NA | 0.12 | 0.12 | 0.16 | 2.55 | 1.74 | 1.28 | NA | NA | NA | NA | NA | NA | 0.13 | 0.05 | 0.10 | 1.57 | 1.70 | 1.88 |
| PUTRESCINE | ME392417 | 0.19 | 0.02 | 0.00 | 0.24 | 0.03 | NA | NA | NA | NA | NA | NA | NA | 0.18 | 0.03 | 1.48 | 0.02 | NA | NA | 4.59 | 7.14 | 0.23 | 2.96 | 0.12 | 0.23 | 3.90 | 0.14 | 0.59 | 0.39 | 0.39 | 0.97 | 0.85 | 0.80 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.21 | 0.22 | 0.15 |
| 2,6-DIMETHOXYBENZOIC ACID | ME392187 | 0.16 | 0.14 | 0.17 | 0.25 | 0.17 | 0.17 | 1.75 | 2.01 | 4.21 | NA | NA | NA | 5.76 | 3.28 | 1.06 | 4.65 | 2.64 | 1.16 | NA | NA | 0.44 | 0.31 | 0.28 | 0.42 | 0.80 | 0.66 | 1.34 | 1.26 | 1.25 | NA | NA | NA | 0.41 | 0.46 | 0.20 | 0.14 | 0.25 | 0.14 | 0.84 | 0.91 | 0.71 | NA | NA | NA |
| DEOXYCARNITINE | ME392296 | 0.42 | 0.46 | 0.08 | 0.25 | 0.43 | 0.06 | 0.80 | 0.71 | 1.06 | 0.08 | 0.05 | 0.05 | 3.47 | 0.17 | 3.76 | 0.14 | 1.07 | 1.29 | 0.11 | 0.14 | 0.26 | 1.76 | 0.17 | 0.74 | 4.76 | 0.39 | 3.26 | 2.74 | 3.09 | 0.09 | 0.07 | 0.06 | 0.17 | 0.14 | 0.23 | 0.10 | 0.09 | 0.16 | 0.70 | 0.59 | 0.64 | 0.07 | 0.06 | 0.08 |
| LEUCINE, NORLEUCINE | ME392349 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.04 | 0.03 | 0.03 | 0.99 | 0.91 | 0.70 | 0.66 | 1.18 | 1.22 | 0.05 | 0.05 | NA | NA | NA | NA | NA | NA | 4.24 | 4.73 | 4.65 | 0.19 | 0.18 | 0.13 | 1.21 | 1.13 | 1.12 | 0.20 | 0.34 | 0.46 | 0.83 | 0.71 | 0.77 | 0.03 | 0.03 | 0.03 |
| ACETYL-CARNITINE | ME392239 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.02 | 0.13 | 0.04 | 0.00 | 0.04 | 0.03 | 0.04 | 0.00 | 0.06 | NA | 0.04 | 1.80 | 2.48 | NA | NA | NA | NA | NA | NA | NA | NA | 5.68 | 4.49 | 4.89 | 0.24 | 0.09 | 0.16 | 0.11 | 0.07 | 0.08 | 0.10 | 0.04 | 0.06 | 0.22 | 0.19 | 0.28 | 0.01 | 0.02 | 0.04 |
| PROPIONYLCARNITINE | ME392413 | NA | NA | NA | NA | NA | NA | 0.56 | 0.44 | 0.60 | 0.06 | 0.04 | 0.05 | 0.15 | 0.05 | 0.23 | 0.04 | 2.73 | 3.54 | 0.16 | 0.10 | 0.14 | 0.05 | 0.15 | 0.21 | 0.09 | 0.20 | 5.60 | 5.09 | 3.79 | 0.30 | 0.31 | 0.18 | 0.20 | 0.03 | 0.02 | 0.31 | 0.04 | 0.04 | 0.62 | 0.41 | 0.49 | 0.03 | 0.03 | 0.04 |
| AZELAIC ACID | ME392263 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 2.13 | 1.72 | 3.35 | 0.02 | 0.01 | 0.01 | 0.01 | 0.02 | 0.01 | 0.00 | 1.59 | 2.13 | NA | NA | NA | NA | NA | NA | NA | NA | 2.73 | 2.21 | 2.80 | NA | NA | NA | 0.04 | 0.04 | 0.04 | 0.03 | 0.05 | 0.04 | 2.54 | 2.12 | 2.92 | 0.01 | 0.01 | 0.01 |
| HOMOVANILLIC ACID | ME392331 | NA | NA | NA | NA | NA | NA | 1.01 | 0.81 | 1.59 | 0.18 | 0.18 | 0.13 | NA | NA | NA | NA | 2.43 | 4.33 | 0.93 | 0.56 | NA | NA | NA | NA | NA | NA | 1.84 | 1.51 | 2.02 | 0.10 | 0.09 | 0.07 | NA | NA | NA | NA | NA | NA | 0.55 | 0.53 | 0.63 | 0.09 | 0.08 | 0.09 |
| ADIPIC ACID | ME392245 | NA | NA | NA | NA | NA | NA | 1.19 | 0.92 | 1.90 | 0.17 | 0.14 | 0.11 | 0.10 | 0.05 | 0.04 | 0.06 | 5.40 | 6.78 | 0.95 | 0.23 | NA | NA | NA | NA | NA | NA | 1.51 | 1.28 | 1.58 | 0.24 | 0.08 | 0.21 | NA | NA | NA | NA | NA | NA | 0.72 | 0.75 | 0.81 | 0.10 | 0.07 | 0.07 |
| SUBERIC ACID | ME392440 | NA | NA | NA | NA | NA | NA | 1.35 | 1.10 | 2.35 | 0.10 | 0.10 | 0.09 | 0.16 | 0.15 | 0.17 | 0.15 | 4.50 | 6.05 | 0.02 | 0.02 | 0.10 | 0.09 | 0.08 | 0.09 | 0.08 | 0.07 | 2.60 | 2.14 | 2.78 | NA | NA | NA | 0.06 | 0.06 | 0.05 | 0.05 | 0.05 | 0.04 | 1.07 | 0.96 | 1.22 | NA | NA | NA |
| METHYL INDOLE-3-ACETATE | ME392357 | 1.48 | 1.27 | 2.27 | 0.37 | 0.28 | 0.97 | 0.90 | 0.40 | 0.44 | 1.48 | 0.94 | 1.65 | NA | NA | NA | NA | NA | NA | NA | NA | 0.23 | 0.43 | 0.21 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.31 | 0.93 | 0.90 | 0.16 | 0.38 | 0.16 | 1.53 | 3.11 | 1.91 | 0.56 | 0.15 | 0.43 |
| 5^-METHYLTHIOADENOSINE | ME392236 | 1.55 | 1.62 | 0.50 | 1.56 | 1.67 | 0.42 | 0.15 | 0.13 | 0.20 | 3.03 | 4.07 | 3.53 | NA | NA | NA | NA | NA | NA | NA | NA | 0.19 | 0.36 | 0.31 | 0.40 | 0.41 | 0.58 | NA | NA | NA | 0.79 | 0.52 | 0.43 | 1.03 | 0.51 | 0.93 | 0.29 | 0.30 | 0.48 | 0.42 | 0.39 | 0.36 | 2.85 | 3.60 | 2.58 |
| PROGESTERONE-D9 | ME392411 | 1.09 | 1.01 | 1.50 | 0.87 | 0.97 | 1.47 | 1.00 | 1.27 | 1.01 | 2.39 | 2.41 | 2.65 | NA | NA | NA | NA | NA | NA | NA | NA | 0.58 | 0.52 | 0.50 | 0.61 | 0.55 | 0.60 | 0.50 | 0.54 | 0.66 | 0.83 | 0.87 | 0.62 | 1.16 | 1.27 | 1.22 | 1.39 | 1.26 | 1.49 | 0.97 | 0.61 | 1.25 | 1.77 | 1.78 | 1.73 |
| 5-AMINOPENTANOIC ACID, VALINE | ME392223 | 0.07 | 0.28 | 0.00 | 0.16 | 0.20 | 0.00 | NA | NA | NA | 0.01 | 0.01 | 0.00 | NA | 0.87 | 0.33 | 0.49 | NA | NA | NA | NA | 0.98 | 0.95 | 0.74 | 3.03 | 2.76 | 1.61 | 1.18 | 0.99 | 1.15 | 0.10 | 0.13 | 0.10 | 0.80 | 5.59 | 0.97 | 0.18 | 4.90 | 0.33 | NA | NA | NA | 0.00 | 0.03 | 0.00 |
| THYMIDINE | ME392446 | 0.62 | 0.67 | 0.71 | 0.17 | 0.48 | 0.63 | NA | NA | NA | NA | NA | NA | 2.42 | 2.45 | 4.41 | 2.78 | NA | NA | 1.32 | 1.36 | NA | NA | NA | 0.68 | 0.14 | 1.00 | NA | NA | NA | 0.75 | 0.31 | 0.28 | 1.20 | 0.39 | 1.83 | 0.62 | 0.18 | 2.03 | NA | NA | NA | 0.69 | 0.56 | 0.58 |
| URIDINE | ME392460 | 0.29 | 0.38 | 0.60 | 0.24 | 0.41 | 0.59 | 0.89 | 0.94 | 1.14 | 0.30 | 0.30 | 0.34 | 1.74 | 2.10 | 1.92 | 2.79 | 1.77 | 3.28 | 0.76 | 0.96 | NA | NA | NA | 2.53 | 1.12 | 3.26 | NA | NA | NA | 0.68 | 0.70 | 0.53 | 0.63 | 0.32 | 1.43 | 0.73 | 0.26 | 2.79 | 1.40 | 0.97 | 0.79 | 0.39 | 0.44 | 0.39 |
| CADAVERINE | ME392268 | 1.28 | 2.49 | 0.04 | 1.39 | 3.95 | 0.04 | NA | NA | NA | 0.27 | 0.34 | 0.19 | NA | NA | NA | NA | NA | NA | 0.21 | 0.76 | 0.81 | 3.85 | 0.34 | 1.00 | 1.69 | 0.49 | NA | NA | NA | 1.37 | 0.87 | 0.29 | 0.10 | 1.39 | 0.07 | 0.18 | 1.64 | 0.08 | NA | NA | NA | 0.11 | 0.20 | 0.13 |
| PYROGLUTAMIC ACID | ME392422 | 0.84 | 1.06 | 0.41 | 0.49 | 0.77 | 0.22 | 1.51 | 1.93 | 2.99 | 1.13 | 0.99 | 0.85 | 0.51 | 0.53 | 0.45 | 0.24 | 0.92 | 1.02 | 0.44 | 1.31 | 1.45 | 2.02 | 1.23 | NA | NA | NA | 0.89 | 0.50 | 0.79 | 1.80 | 1.72 | 0.98 | 0.30 | 0.37 | 0.44 | 0.19 | 0.18 | 0.16 | 1.20 | 1.08 | 1.06 | 0.76 | 0.64 | 0.68 |
| METHIONINE | ME392355 | 0.64 | 1.10 | 0.28 | 0.55 | 0.69 | 0.28 | 1.24 | 1.36 | 1.40 | 0.44 | 0.23 | 0.15 | 1.92 | 1.74 | 1.20 | 1.01 | NA | NA | 0.11 | 0.23 | 0.72 | 0.39 | 0.65 | 2.62 | 1.04 | 1.58 | 2.66 | 1.56 | 1.68 | 0.08 | 0.05 | 0.04 | 1.64 | 1.02 | 1.31 | 0.49 | 0.41 | 0.48 | 1.29 | 1.16 | 1.03 | 0.17 | 0.11 | 0.12 |
| TYROSINE | ME392458 | 0.47 | 0.61 | 0.39 | 0.49 | 0.40 | 0.30 | 0.75 | 0.73 | 1.21 | 0.04 | 0.02 | 0.02 | 2.19 | 1.56 | 1.74 | 0.90 | 2.20 | 2.29 | 0.05 | 0.05 | 3.03 | 0.97 | 2.46 | 3.05 | 0.73 | 2.03 | 2.08 | 1.41 | 1.65 | 0.06 | 0.04 | 0.03 | 0.79 | 0.79 | 0.74 | 0.34 | 0.28 | 0.50 | 1.24 | 0.94 | 1.16 | 0.02 | 0.01 | 0.02 |
| PHENYLALANINE | ME392406 | 0.30 | 0.39 | 0.23 | 0.33 | 0.26 | 0.20 | 0.45 | 0.46 | 0.71 | 0.01 | 0.01 | 0.01 | 1.12 | 1.02 | 0.75 | 0.66 | 1.11 | 1.17 | 0.04 | 0.03 | 2.64 | 2.59 | 2.34 | 3.00 | 2.79 | 1.56 | 1.87 | 1.44 | 1.67 | 0.05 | 0.04 | 0.03 | 0.99 | 0.75 | 0.93 | 0.23 | 0.20 | 0.30 | 0.63 | 0.52 | 0.55 | 0.01 | 0.01 | 0.01 |
| SN-GLYCERO-3-PHOSPHOCHOLINE | ME392435 | 0.43 | 1.24 | 0.42 | 0.68 | 1.14 | 0.58 | 0.57 | 0.33 | 0.21 | 0.08 | 0.10 | 0.09 | 0.42 | 1.78 | 1.10 | 1.77 | 1.36 | 1.38 | 0.16 | 0.79 | 1.98 | 1.19 | 1.68 | 1.75 | 1.69 | 1.74 | 1.92 | 1.52 | 1.91 | 0.59 | 0.48 | 0.30 | 0.74 | 0.78 | 0.55 | 0.71 | 0.62 | 0.43 | 1.01 | 1.05 | 1.11 | 0.13 | 0.12 | 0.40 |
| SPHINGANINE | ME392438 | 0.32 | 0.32 | 0.41 | 0.30 | 0.37 | 0.43 | 0.55 | 0.55 | 0.48 | 0.86 | 0.80 | 0.98 | NA | NA | NA | NA | NA | NA | NA | NA | 0.91 | 0.83 | 0.81 | 0.90 | 0.89 | 0.88 | 3.69 | 3.40 | 4.66 | 1.18 | 1.17 | 1.10 | NA | NA | NA | NA | NA | NA | 0.50 | 0.49 | 0.50 | 0.65 | 0.63 | 0.67 |
| 3-HYDROXYPROPIONIC ACID | ME392192 | 0.03 | 0.04 | 0.35 | 0.06 | 0.11 | 0.34 | NA | NA | NA | NA | NA | NA | 0.09 | 0.86 | 0.06 | 1.04 | 0.67 | 0.76 | NA | NA | 1.98 | 0.48 | 1.80 | 2.08 | 0.53 | 2.09 | 3.55 | 2.57 | 3.19 | NA | NA | NA | 0.03 | 0.44 | 0.52 | 0.08 | 0.42 | 0.63 | 0.33 | 0.27 | 0.27 | NA | NA | NA |
| TRYPTOPHAN | ME392454 | 0.10 | 0.15 | 0.13 | 0.11 | 0.10 | 0.12 | 0.81 | 0.76 | 1.36 | 0.01 | 0.01 | 0.01 | 0.41 | 0.78 | 0.30 | 0.46 | 1.74 | 2.17 | 0.02 | 0.02 | 2.36 | 1.54 | 1.40 | 1.67 | 1.37 | 0.73 | 3.81 | 2.88 | 3.88 | 0.03 | 0.02 | 0.01 | 0.57 | 0.41 | 0.60 | 0.14 | 0.12 | 0.18 | 1.20 | 0.93 | 1.14 | 0.01 | 0.01 | 0.01 |
| BETAINE | ME392266 | 0.20 | 0.24 | 0.17 | 0.26 | 0.30 | 0.18 | 0.98 | 0.98 | 0.84 | 1.75 | 1.00 | 0.94 | 0.62 | 0.41 | 0.77 | 0.45 | 1.56 | 1.11 | 3.15 | 1.06 | 0.72 | 0.86 | 0.77 | 0.91 | 0.90 | 0.82 | 2.94 | 2.63 | 2.27 | NA | NA | NA | 0.43 | 0.41 | 0.45 | 0.39 | 0.79 | 0.53 | 0.85 | 0.84 | 0.85 | 0.88 | 0.49 | 0.55 |
| CARNITINE | ME392271 | 0.10 | 0.18 | 0.15 | 0.06 | 0.17 | 0.13 | 1.18 | 1.28 | 1.19 | 0.94 | 0.53 | 0.81 | 0.10 | 0.18 | 0.07 | 0.12 | 2.04 | 1.60 | 1.49 | 1.41 | 0.73 | 0.60 | 0.84 | 0.62 | 0.36 | 0.65 | 3.17 | 2.97 | 2.74 | 1.94 | 1.77 | 1.47 | 0.14 | 0.13 | 0.32 | 0.08 | 0.08 | 0.18 | 0.94 | 0.90 | 0.89 | 0.71 | 0.44 | 0.80 |
| 5-HYDROXYMETHYL-2-FURANCARBOXYLIC ACID | ME392228 | NA | NA | NA | NA | NA | NA | 0.34 | 0.27 | 0.45 | 0.42 | 0.37 | 0.29 | NA | NA | NA | NA | 0.96 | 0.89 | 1.56 | 0.98 | NA | NA | NA | NA | NA | NA | 2.59 | 2.16 | 2.47 | 1.04 | 0.95 | 0.50 | NA | NA | NA | NA | NA | NA | 0.29 | 0.29 | 0.28 | 0.34 | 0.27 | 0.26 |
| PHENYLACETIC ACID | ME392403 | NA | NA | NA | NA | NA | NA | 0.44 | 0.33 | 0.48 | 0.68 | 0.47 | 0.32 | NA | NA | NA | NA | 2.02 | 1.51 | 0.59 | 1.29 | NA | NA | NA | NA | NA | NA | 1.87 | 1.67 | 1.86 | 1.24 | 1.09 | 0.44 | NA | NA | NA | NA | NA | NA | 0.70 | 0.69 | 0.69 | 0.52 | 0.32 | 0.62 |
| ORNITHINE | ME392396 | NA | NA | NA | NA | NA | NA | 0.38 | 0.32 | 0.44 | NA | NA | NA | 0.14 | 0.05 | 0.91 | 0.07 | 0.63 | 1.15 | NA | NA | 1.31 | 0.76 | 0.99 | 1.35 | 1.09 | 0.94 | 2.46 | 1.52 | 2.77 | 0.77 | 2.50 | 0.42 | 0.53 | 0.11 | 0.31 | 0.23 | 0.04 | 0.17 | 0.47 | 0.41 | 0.44 | NA | NA | NA |
| TRYPTOPHAN-2,4,5,6,7-D5 | ME392455 | 0.35 | 0.35 | 0.36 | 0.35 | 0.37 | 0.35 | 0.34 | 0.44 | 0.53 | 0.34 | 0.36 | 0.32 | 0.86 | 1.00 | 0.85 | 1.00 | 1.44 | 1.40 | 1.56 | 1.61 | 1.37 | 1.22 | 1.21 | 1.42 | 1.20 | 1.27 | 1.74 | 1.56 | 1.54 | 1.80 | 1.27 | 1.57 | 0.98 | 1.01 | 0.95 | 0.96 | 0.98 | 0.84 | 0.45 | 0.39 | 0.40 | 0.40 | 0.41 | 0.40 |
| 4-BROMO-PHENYLALANINE | ME392208 | 0.27 | 0.25 | 0.29 | 0.25 | 0.28 | 0.26 | 0.32 | 0.40 | 0.50 | NA | NA | NA | 0.60 | 0.72 | 0.62 | 0.69 | 1.06 | 1.03 | 1.01 | 1.02 | 1.49 | 1.30 | 1.31 | 1.53 | 1.28 | 1.35 | 1.91 | 1.75 | 1.70 | 1.83 | 1.65 | 1.65 | 0.56 | 0.57 | 0.53 | 0.50 | 0.53 | 0.44 | 0.41 | 0.35 | 0.36 | 0.34 | 0.34 | 0.33 |
| LEUCINE-5,5,5-D3 | ME392348 | 0.29 | 0.27 | 0.33 | 0.28 | 0.30 | 0.32 | 0.34 | 0.43 | 0.47 | 0.44 | 0.41 | 0.41 | 0.50 | 0.54 | 0.53 | 0.57 | 0.77 | 0.72 | 1.22 | 0.83 | 1.18 | 1.07 | 1.07 | 1.29 | 1.11 | 1.24 | 1.88 | 1.70 | 1.59 | 2.37 | 2.02 | 2.14 | NA | NA | NA | NA | NA | NA | 0.37 | 0.32 | 0.31 | 0.46 | 0.45 | 0.45 |
| PHENYLALANINE-2,3,4,5,6-D5 | ME392407 | 0.31 | 0.28 | 0.33 | 0.29 | 0.30 | 0.29 | 0.34 | 0.46 | 0.57 | 0.37 | 0.42 | 0.35 | 0.59 | 0.66 | 0.58 | 0.66 | 0.97 | 1.01 | 1.27 | 1.34 | 1.38 | 1.27 | 1.26 | 1.45 | 1.23 | 1.33 | 1.79 | 1.64 | 1.59 | 1.86 | 1.65 | 1.61 | NA | NA | NA | NA | NA | NA | 0.46 | 0.41 | 0.41 | 0.39 | 0.38 | 0.39 |
| SPERMIDINE | ME392436 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.15 | 0.22 | 0.11 | 1.28 | 0.42 | 1.93 | 0.39 | 0.29 | 0.18 | 1.27 | 1.36 | 0.42 | 0.27 | 0.28 | 1.35 | 0.85 | 0.84 | 1.37 | 0.92 | 1.16 | 2.45 | 0.86 | 1.10 | 2.26 | 0.76 | 0.31 | 2.34 | 0.78 | 0.40 | NA | NA | NA | NA | NA | NA |
| GLUCOSE-1,2,3,4,5,6,6-D7 | ME392317 | 0.65 | 0.40 | 0.53 | 0.42 | 0.25 | 0.61 | 0.35 | 0.39 | 0.45 | 0.32 | 0.26 | 0.20 | 1.49 | 1.48 | 0.95 | 1.10 | 1.05 | 0.97 | 0.48 | 0.20 | 1.27 | 2.53 | 0.96 | 1.07 | 1.96 | 0.85 | 1.20 | 1.19 | 1.29 | 0.47 | 0.41 | 1.03 | 2.19 | 1.96 | 1.91 | 1.45 | 1.43 | 1.70 | NA | NA | NA | NA | NA | NA |
| METHIONINE-METHYL-D3 | ME392356 | 0.73 | 0.78 | 0.74 | 0.69 | 0.81 | 0.78 | 0.63 | 0.86 | 0.97 | 0.68 | 0.68 | 0.60 | 0.69 | 1.65 | 0.73 | 1.68 | NA | NA | 1.49 | 1.81 | 1.12 | 1.14 | 1.12 | 1.27 | 1.16 | 1.13 | 0.98 | 0.98 | 0.89 | 0.35 | 0.38 | 0.28 | 1.80 | 1.72 | 1.67 | 1.78 | 1.72 | 1.53 | 0.60 | 0.59 | 0.49 | 0.76 | 0.78 | 0.79 |
| N-ACETYL-METHIONINE | ME392369 | 0.63 | 0.88 | 0.33 | 0.50 | 0.86 | 0.26 | NA | NA | NA | 1.09 | 0.62 | 0.62 | 0.91 | 2.27 | 1.11 | 2.28 | NA | NA | 1.87 | 1.66 | 0.85 | 0.93 | 0.64 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.94 | 1.94 | 1.23 | 1.88 | 1.87 | 1.17 | 0.16 | 0.12 | 0.18 | 0.60 | 0.73 | 0.75 |
| N-ALPHA-ACETYL-LYSINE | ME392377 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.29 | 0.35 | 0.29 | 0.05 | 1.00 | 0.08 | 1.34 | NA | NA | NA | NA | NA | NA | NA | 3.39 | 2.55 | 3.92 | 0.13 | 0.10 | 0.13 | 1.01 | 0.85 | 0.77 | 0.94 | 1.68 | 1.58 | 2.15 | 1.83 | 1.90 | NA | NA | NA | 0.13 | 0.10 | 0.16 |
| CYTIDINE | ME392288 | 0.40 | 0.51 | 0.67 | 0.44 | 0.64 | 0.64 | NA | NA | NA | NA | NA | NA | 0.13 | 1.28 | 0.37 | 2.09 | 0.15 | 0.19 | NA | NA | NA | NA | NA | 1.06 | 0.51 | 1.49 | 0.93 | 0.98 | 0.94 | 1.17 | 0.43 | 1.37 | 1.82 | 0.82 | 2.56 | 1.70 | 0.82 | 2.84 | NA | NA | NA | NA | NA | NA |
| ALPHA-RHAMNOSE, FUCOSE | ME392255 | 0.39 | 0.39 | 0.51 | 0.42 | 0.45 | 0.61 | NA | NA | NA | NA | NA | NA | 0.25 | 1.24 | 0.33 | 1.79 | NA | NA | NA | NA | 0.39 | 0.65 | 3.66 | 0.33 | 0.59 | 2.74 | 0.90 | 0.68 | 0.73 | NA | NA | NA | 1.47 | 0.79 | 1.26 | 2.80 | 1.37 | 1.87 | NA | NA | NA | NA | NA | NA |
| GALACTITOL, MANNITOL | ME392310 | 0.30 | 0.30 | 0.50 | 0.34 | 0.33 | 0.60 | NA | NA | NA | NA | NA | NA | 0.14 | 1.47 | 0.16 | 2.23 | NA | NA | NA | NA | 0.39 | 0.42 | 2.37 | 0.36 | 0.43 | 3.09 | NA | NA | NA | 0.41 | 0.52 | 0.69 | 1.73 | 0.70 | 1.36 | 3.97 | 1.48 | 2.49 | NA | NA | NA | NA | NA | NA |
| D15-OCTANOIC ACID | ME392291 | 0.50 | 0.45 | 0.42 | 0.53 | 0.44 | 0.41 | 0.90 | 1.11 | 1.17 | 0.62 | 0.63 | 0.52 | NA | NA | NA | NA | NA | NA | NA | NA | 1.09 | 0.89 | 0.96 | 1.06 | 0.88 | 1.05 | 1.10 | 0.99 | 1.66 | 2.47 | 2.58 | 1.52 | 0.27 | 0.28 | 0.25 | 0.15 | 0.22 | 0.12 | 1.01 | 0.84 | 0.97 | 1.23 | 1.17 | 1.24 |
| D19-DECANOIC ACID | ME392292 | 0.28 | 0.24 | 0.22 | 0.27 | 0.21 | 0.21 | 0.63 | 0.92 | 0.70 | 0.69 | 0.69 | 0.52 | NA | NA | NA | NA | NA | NA | NA | NA | 1.61 | 1.34 | 1.36 | 1.50 | 1.21 | 1.47 | 0.74 | 0.68 | 0.99 | 2.19 | 2.98 | 0.96 | 0.70 | 0.77 | 0.67 | 0.45 | 0.57 | 0.32 | 0.55 | 0.33 | 0.86 | 1.08 | 1.04 | 1.09 |
| CYSTINE | ME392287 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.57 | 0.43 | 0.55 | 0.20 | 0.94 | 0.07 | 1.04 | NA | NA | 0.41 | 1.31 | 1.11 | 0.84 | 0.76 | 1.42 | 0.59 | 0.99 | NA | NA | NA | 3.10 | 1.79 | 1.55 | 0.26 | 0.32 | 0.53 | 0.13 | 0.23 | 0.52 | NA | NA | NA | 0.46 | 0.49 | 0.62 |
| HOMOCITRULLINE | ME392329 | 0.22 | 0.28 | 0.21 | 0.27 | 0.26 | 0.16 | 0.14 | 0.15 | 0.15 | NA | NA | NA | 0.13 | 0.48 | 0.19 | 0.46 | 0.25 | 0.11 | NA | NA | 1.71 | 1.05 | 1.44 | 1.89 | 1.88 | 1.45 | 0.56 | 0.55 | 0.66 | 2.72 | 2.53 | 1.79 | 0.84 | 0.78 | 0.85 | 0.96 | 0.77 | 0.84 | NA | NA | NA | 0.18 | 0.18 | 0.22 |
| NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE | ME392386 | 0.10 | 0.17 | 0.16 | 0.08 | 0.15 | 0.15 | NA | NA | NA | 0.71 | 0.72 | 0.86 | 0.17 | 0.32 | 0.24 | 0.36 | NA | NA | 0.76 | 0.83 | 1.63 | 1.39 | 1.79 | 1.97 | 1.75 | 2.30 | 0.13 | 0.18 | 0.19 | 2.31 | 3.36 | 1.98 | 0.29 | 0.31 | 0.41 | 0.27 | 0.18 | 0.39 | NA | NA | NA | 0.46 | 0.38 | 0.43 |
| CREATININE | ME392285 | 0.28 | 0.41 | 0.20 | 0.29 | 0.54 | 0.18 | 0.00 | 0.00 | 0.01 | 0.84 | 0.75 | 0.73 | 0.02 | 0.77 | 0.03 | 0.98 | 0.01 | 0.01 | 1.20 | 2.04 | 2.48 | 1.77 | 1.66 | 2.66 | 2.33 | 2.06 | 0.04 | 0.02 | 0.03 | 1.51 | 1.40 | 0.88 | 1.28 | 1.86 | 1.06 | 1.68 | 2.18 | 1.35 | 0.00 | 0.00 | 0.01 | 1.38 | 1.12 | 1.15 |
| D27-TETRADECANOIC ACID | ME392293 | 0.51 | 0.43 | 0.37 | 0.44 | 0.25 | 0.25 | 0.91 | 1.21 | 0.98 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.45 | 0.71 | 0.35 | 1.90 | 1.72 | 1.97 | 0.39 | 0.94 | 1.33 | 1.88 | 1.03 | 0.64 | 1.68 | 1.68 | 1.62 | 1.10 | 1.31 | 0.92 | 0.59 | 0.43 | 1.00 | 1.30 | 1.28 | 1.41 |
| TRIDECANOIC ACID | ME392451 | 0.31 | 0.26 | 0.24 | 0.25 | 0.17 | 0.15 | 0.52 | 0.67 | 0.45 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.67 | 1.51 | 1.48 | 1.41 | 0.93 | 1.31 | 0.69 | 0.54 | 0.99 | 1.10 | 1.49 | 0.27 | 2.70 | 2.96 | 2.70 | 1.74 | 2.26 | 1.45 | 0.32 | 0.26 | 0.47 | 0.40 | 0.41 | 0.55 |
| O-ACETYL-SERINE | ME392393 | 1.11 | 1.51 | 0.54 | 1.20 | 1.71 | 0.44 | NA | NA | NA | 0.02 | 0.08 | 0.02 | 0.02 | 2.26 | 0.60 | 2.02 | NA | NA | NA | NA | 2.92 | 0.35 | 2.04 | 2.46 | 0.21 | 1.99 | NA | NA | NA | 0.40 | 0.44 | 0.31 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ASPARTIC ACID | ME392262 | 0.67 | 0.71 | 0.39 | 0.79 | 0.76 | 0.41 | NA | NA | NA | NA | NA | NA | 3.59 | 1.11 | 2.25 | 1.11 | NA | NA | NA | NA | 1.46 | 1.67 | 1.82 | 1.39 | 1.16 | 1.86 | NA | NA | NA | 0.03 | 0.03 | 0.03 | 1.08 | 1.39 | 0.86 | 0.64 | 1.09 | 0.73 | NA | NA | NA | NA | NA | NA |
| GLUTAMIC ACID, N-METHYL-ASPARTIC ACID | ME392318 | 0.57 | 0.66 | 0.28 | 0.58 | 0.89 | 0.24 | 0.01 | 0.00 | 0.01 | NA | NA | NA | 2.03 | 0.64 | 2.55 | 0.69 | NA | NA | NA | NA | 2.22 | 0.49 | 2.10 | 1.92 | 0.28 | 2.12 | NA | NA | NA | NA | NA | NA | 1.23 | 1.26 | 0.58 | 1.22 | 1.16 | 0.56 | NA | NA | NA | NA | NA | NA |
| CHOLINE | ME392276 | 0.62 | 0.12 | 0.26 | 0.84 | 0.14 | 0.27 | 0.13 | 0.13 | 0.14 | 0.13 | 0.06 | 0.14 | 0.31 | 0.55 | 0.29 | 0.77 | 0.12 | 0.18 | 0.11 | 0.17 | 3.16 | 3.33 | 1.94 | 3.41 | 3.29 | 1.85 | 1.01 | 0.80 | 0.97 | 0.62 | 0.59 | 0.42 | 1.03 | 0.19 | 0.62 | 1.69 | 0.08 | 0.71 | 0.13 | 0.10 | 0.15 | 0.14 | 0.07 | 0.12 |
| ARGININE | ME392259 | 0.18 | 0.34 | 0.41 | 0.16 | 0.26 | 0.30 | 0.01 | 0.01 | 0.01 | 0.02 | 0.02 | 0.04 | 0.70 | 0.83 | 0.32 | 0.70 | 0.08 | 0.08 | 0.02 | 0.02 | 4.18 | 3.63 | 3.27 | 3.19 | 4.48 | 2.36 | 0.18 | 0.14 | 0.13 | 0.07 | 0.04 | 0.02 | 0.52 | 0.32 | 0.66 | 0.41 | 0.17 | 0.37 | 0.03 | 0.03 | 0.04 | 0.02 | 0.03 | 0.02 |
| LYSINE | ME392352 | 0.21 | 0.40 | 0.38 | 0.24 | 0.35 | 0.28 | 0.15 | 0.16 | 0.16 | 0.03 | 0.03 | 0.03 | 0.92 | 0.87 | 0.94 | 0.77 | 0.21 | 0.30 | NA | NA | 3.70 | 2.89 | 2.99 | 3.20 | 4.15 | 2.28 | 0.47 | 0.38 | 0.42 | 0.09 | 0.22 | 0.05 | 0.95 | 0.78 | 1.05 | 0.57 | 0.45 | 0.53 | 0.10 | 0.09 | 0.11 | 0.02 | 0.02 | 0.01 |
| PROLINE | ME392412 | 0.91 | 0.18 | 0.80 | 0.68 | 0.10 | 0.43 | 0.06 | 0.06 | 0.07 | NA | NA | NA | 0.25 | 0.88 | 0.24 | 0.46 | 0.06 | 0.10 | NA | NA | 3.37 | 2.59 | 2.70 | 2.50 | 1.20 | 1.28 | 0.34 | 0.22 | 0.27 | NA | NA | NA | 2.52 | 0.15 | 1.73 | 0.68 | 0.07 | 0.80 | 0.07 | 0.05 | 0.07 | NA | NA | NA |
| HISTIDINE | ME392328 | 0.12 | 0.16 | 0.20 | 0.15 | 0.19 | 0.18 | NA | NA | NA | NA | NA | NA | 0.14 | 0.55 | 0.18 | 0.47 | 0.04 | 0.04 | 0.04 | 0.05 | 3.53 | 1.60 | 2.58 | 2.92 | 2.50 | 1.79 | 0.08 | 0.08 | 0.08 | NA | NA | NA | 0.23 | 0.35 | 0.53 | 0.26 | 0.29 | 0.37 | NA | NA | NA | 0.03 | 0.02 | 0.03 |
| PYRIDOXAMINE | ME392419 | 0.19 | 0.34 | 0.30 | 0.18 | 0.22 | 0.22 | 0.26 | 0.30 | 0.30 | NA | NA | NA | 0.82 | 0.96 | 0.44 | 0.52 | NA | NA | NA | NA | 2.49 | 2.47 | 2.23 | 2.04 | 1.80 | 1.63 | NA | NA | NA | NA | NA | NA | 0.62 | 0.51 | 0.76 | 0.29 | 0.22 | 0.35 | 0.26 | 0.24 | 0.32 | NA | NA | NA |
| ALPHA-AMINOADIPIC ACID | ME392252 | 0.08 | 0.12 | 0.08 | 0.08 | 0.13 | 0.05 | 0.02 | 0.02 | 0.06 | NA | NA | NA | 0.01 | 1.85 | 0.01 | 2.15 | NA | NA | NA | NA | 2.06 | 1.85 | 2.03 | 2.34 | 3.27 | 2.15 | NA | NA | NA | 0.47 | 0.51 | 0.29 | 1.18 | 1.37 | 0.84 | 1.00 | 1.55 | 0.75 | 0.08 | 0.02 | 0.03 | 0.04 | 0.02 | 0.03 |
| GLUCONO-1,5-LACTONE, GULONIC ACID GAMMA-LACTONE | ME392314 | 0.20 | 0.21 | 0.33 | 0.28 | 0.21 | 0.35 | NA | NA | NA | NA | NA | NA | 0.09 | 0.98 | 0.08 | 1.12 | NA | NA | NA | NA | 1.81 | 1.55 | 1.94 | 2.06 | 2.40 | 2.49 | NA | NA | NA | 0.63 | 0.94 | 0.60 | 1.44 | 1.05 | 0.94 | 1.18 | 0.99 | 1.02 | NA | NA | NA | NA | NA | NA |
| FRUCTOSE, GULOSE, MANNOSE, MYO-INOSITOL, SORBOSE | ME392308 | 0.28 | 0.29 | 0.30 | 0.44 | 0.44 | 0.45 | NA | NA | NA | NA | NA | NA | 0.40 | 1.31 | 0.50 | 2.13 | NA | NA | NA | NA | 1.25 | 0.71 | 1.42 | 1.37 | 1.53 | 2.04 | NA | NA | NA | NA | NA | NA | 0.38 | 0.97 | 0.91 | 0.96 | 1.54 | 1.68 | NA | NA | NA | NA | NA | NA |
| DEOXYCYTIDINE | ME392297 | 0.17 | 0.28 | 0.10 | 0.15 | 0.32 | 0.19 | NA | NA | NA | NA | NA | NA | 0.00 | 0.95 | NA | 1.12 | NA | NA | NA | NA | 2.03 | 0.63 | 1.94 | 2.36 | 0.95 | 2.32 | NA | NA | NA | 0.41 | 0.35 | 0.32 | 0.79 | 0.58 | 0.89 | 0.82 | 0.68 | 1.13 | NA | NA | NA | NA | NA | NA |
| BETA-LACTOSE, LACTULOSE, MALTOSE, MELIBIOSE, SUCROSE | ME392265 | 0.12 | 0.10 | 0.27 | 0.12 | 0.13 | 0.38 | NA | NA | NA | NA | NA | NA | 0.00 | 1.34 | 0.00 | 1.32 | 0.17 | 0.20 | NA | NA | 2.48 | 0.35 | 2.67 | 2.94 | 0.24 | 2.94 | 0.21 | 0.24 | 0.19 | NA | NA | NA | 0.02 | 0.89 | 0.63 | 0.03 | 1.58 | 1.41 | NA | NA | NA | NA | NA | NA |
| MALTOTRIOSE, RAFFINOSE | ME392354 | 0.01 | 0.01 | 0.65 | NA | 0.01 | 0.67 | NA | NA | NA | NA | NA | NA | 0.02 | 1.04 | 0.05 | 1.20 | NA | NA | NA | NA | 1.65 | 0.49 | 2.12 | 2.24 | 0.71 | 2.08 | NA | NA | NA | 0.21 | 0.16 | 0.21 | 0.04 | 1.11 | 1.77 | 0.04 | 1.52 | 2.12 | NA | NA | NA | NA | NA | NA |
| CARNITINE-TRIMETHYL-D9 | ME392272 | 0.21 | 0.34 | 0.36 | 0.20 | 0.37 | 0.39 | 0.06 | 0.08 | 0.07 | 0.18 | 0.13 | 0.15 | 0.76 | 0.54 | 0.91 | 0.55 | 0.16 | 0.16 | 0.32 | 0.37 | 2.74 | 2.10 | 3.47 | 3.00 | 2.41 | 3.97 | 0.55 | 0.63 | 0.53 | 0.86 | 0.93 | 0.99 | 0.45 | 0.88 | 0.68 | 0.59 | 0.98 | 0.78 | 0.05 | 0.06 | 0.05 | 0.17 | 0.14 | 0.18 |
| GALACTOSAMINE, GLUCOSAMINE, MANNOSAMINE | ME392311 | 0.16 | 0.19 | 0.26 | 0.18 | 0.26 | 0.28 | NA | NA | NA | 0.09 | 0.09 | 0.09 | 0.40 | 0.95 | 0.99 | 1.75 | NA | NA | 0.13 | 0.28 | 1.02 | 1.49 | 3.41 | 0.96 | 2.69 | 4.64 | NA | NA | NA | 0.27 | 0.23 | 0.21 | 0.34 | 0.63 | 0.95 | 0.77 | 0.87 | 1.65 | NA | NA | NA | 0.17 | 0.11 | 0.13 |
| AGMATINE | ME392246 | 0.37 | 0.66 | 0.08 | 0.11 | 0.09 | 0.06 | NA | NA | NA | 0.21 | 0.28 | 0.26 | NA | NA | NA | NA | NA | NA | NA | NA | 1.02 | 3.45 | 0.55 | 1.21 | 3.88 | 0.68 | NA | NA | NA | 0.29 | 1.21 | 0.11 | 1.70 | 0.76 | 0.20 | 0.59 | 0.69 | 0.12 | NA | NA | NA | NA | NA | NA |
| METHYL NICOTINIC ACID | ME392358 | 1.27 | 0.75 | 2.09 | 0.77 | 0.33 | 1.65 | NA | NA | NA | NA | NA | NA | 0.02 | 1.07 | 0.01 | 0.25 | NA | NA | NA | NA | 1.56 | 2.87 | 1.21 | 0.65 | 0.30 | 0.27 | NA | NA | NA | NA | NA | NA | 1.09 | 0.90 | 1.06 | 0.06 | 0.23 | 0.13 | NA | NA | NA | NA | NA | NA |
| ASPARAGINE | ME392261 | 0.05 | 0.02 | 0.70 | 0.10 | 0.08 | 0.58 | NA | NA | NA | 0.04 | 0.04 | 0.04 | 0.63 | 1.87 | 0.18 | 1.67 | NA | NA | 0.10 | 0.11 | 1.61 | 0.14 | 1.45 | 6.09 | 0.45 | 4.79 | NA | NA | NA | 0.25 | 0.19 | 0.16 | 0.20 | 0.67 | 1.50 | 0.14 | 0.65 | 1.17 | NA | NA | NA | 0.05 | 0.05 | 0.05 |
| CYTOSINE | ME392290 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.22 | 0.19 | 0.18 | 0.38 | 0.02 | 0.52 | 0.05 | NA | NA | 0.48 | 0.34 | 3.99 | 0.41 | 5.25 | 4.58 | 0.45 | 6.74 | 0.89 | 0.90 | 0.78 | 0.39 | 0.34 | 0.26 | 0.10 | 0.11 | 0.04 | 0.16 | 0.15 | 0.05 | NA | NA | NA | 0.23 | 0.18 | 0.17 |
| 1,6-ANHYDRO-B-GLUCOSE | ME392170 | 0.07 | 0.08 | 0.84 | 0.08 | 0.08 | 0.83 | 0.21 | 0.26 | 0.20 | 0.07 | 0.07 | 0.09 | 0.01 | 1.49 | 0.00 | 1.55 | 0.68 | 0.81 | 0.02 | 0.06 | 3.36 | 0.83 | 3.13 | 3.45 | 1.07 | 3.52 | 1.76 | 1.39 | 1.28 | 0.29 | 0.21 | 0.24 | 0.10 | 1.01 | 1.42 | 0.12 | 1.15 | 1.54 | 0.36 | 0.28 | 0.26 | 0.04 | 0.05 | 0.06 |
| ALLOTHREONINE, HOMOSERINE, THREONINE | ME392251 | 0.16 | 0.21 | 0.84 | 0.17 | 0.19 | 0.64 | 0.02 | 0.02 | 0.02 | 0.02 | 0.02 | 0.01 | 0.79 | 1.96 | 0.73 | 1.69 | 0.04 | 0.08 | 0.03 | 0.03 | 4.83 | 0.62 | 5.18 | 5.08 | 0.34 | 5.12 | 0.15 | 0.10 | 0.14 | 0.06 | 0.06 | 0.04 | 0.39 | 0.34 | 1.71 | 0.08 | 0.15 | 1.34 | 0.04 | 0.03 | 0.05 | 0.02 | 0.02 | 0.02 |
| GLUTAMINE | ME392319 | 0.22 | 0.26 | 0.59 | 0.29 | 0.27 | 0.42 | 0.06 | 0.06 | 0.05 | 0.09 | 0.06 | 0.04 | 0.55 | 1.46 | 0.42 | 1.17 | 0.14 | 0.15 | 0.11 | 0.08 | 5.20 | 0.36 | 4.76 | 5.14 | 0.42 | 4.53 | 0.28 | 0.23 | 0.27 | 0.20 | 0.14 | 0.12 | 0.55 | 0.58 | 1.36 | 0.42 | 0.53 | 0.86 | 0.06 | 0.06 | 0.06 | 0.10 | 0.05 | 0.04 |
| 1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID | ME392161 | 0.30 | 0.37 | 0.59 | 0.33 | 0.47 | 0.45 | NA | NA | NA | 0.04 | 0.03 | 0.03 | 1.73 | 1.30 | 2.18 | 1.26 | 0.03 | 0.04 | 0.08 | 0.05 | 4.20 | 0.77 | 4.30 | 4.35 | 0.55 | 4.22 | 0.10 | 0.07 | 0.09 | 0.09 | 0.08 | 0.07 | 0.72 | 0.78 | 1.13 | 0.60 | 0.65 | 0.95 | 0.02 | 0.02 | 0.02 | 0.03 | 0.03 | 0.02 |
| SERINE | ME392433 | 0.26 | 0.31 | 0.47 | 0.35 | 0.42 | 0.41 | NA | NA | NA | 0.02 | 0.01 | 0.01 | 0.92 | 1.72 | 0.71 | 1.41 | 0.03 | 0.04 | 0.03 | 0.04 | 4.36 | 0.52 | 3.47 | 4.11 | 0.78 | 3.33 | 0.09 | 0.09 | 0.10 | 0.10 | 0.08 | 0.06 | 0.53 | 0.56 | 1.25 | 0.44 | 0.37 | 0.90 | NA | NA | NA | 0.02 | 0.01 | 0.02 |
| ALANINE, BETA-ALANINE, SARCOSINE | ME392247 | 0.17 | 0.23 | 0.12 | 0.17 | 0.20 | 0.09 | 0.02 | 0.02 | 0.02 | 0.02 | 0.01 | 0.01 | 2.42 | 1.20 | 2.88 | 0.71 | 0.11 | 0.16 | 0.03 | 0.03 | 5.51 | 3.97 | 3.92 | 3.64 | 2.88 | 1.75 | 0.24 | 0.18 | 0.25 | 0.08 | 0.09 | 0.05 | 0.18 | 0.17 | 0.21 | 0.08 | 0.07 | 0.10 | 0.04 | 0.04 | 0.04 | 0.01 | 0.01 | 0.01 |
| ALLO-ISOLEUCINE, ISOLEUCINE | ME392250 | 0.14 | 0.04 | 0.32 | 0.38 | 0.21 | 0.22 | 0.62 | 0.62 | 0.94 | NA | NA | NA | 0.88 | 0.93 | 0.61 | 0.57 | 1.23 | 1.16 | 0.06 | 0.03 | 4.20 | 3.38 | 4.98 | 1.41 | 1.07 | 0.78 | 1.34 | 1.24 | 1.34 | 0.05 | 0.03 | 0.03 | 0.75 | 0.42 | 0.65 | 0.15 | 0.24 | 0.39 | 0.82 | 0.71 | 0.81 | 0.01 | 0.01 | 0.01 |
| N-ACETYL-LEUCINE | ME392368 | NA | NA | NA | NA | NA | NA | 0.31 | 0.29 | 0.42 | 2.97 | 1.98 | 1.29 | 0.12 | 0.14 | 0.29 | 0.13 | 3.38 | 2.60 | 4.87 | 6.21 | 0.28 | 0.39 | 0.26 | 0.25 | 0.39 | 0.28 | 1.01 | 1.03 | 0.83 | 0.51 | 0.13 | 0.34 | NA | NA | NA | NA | NA | NA | 0.56 | 0.41 | 0.41 | 0.62 | 0.75 | 1.06 |
| INDOLE-2,4,5,6,7-D5-3-ACETIC ACID | ME392336 | 0.52 | 0.52 | 0.78 | 0.41 | 0.59 | 0.76 | 1.05 | 1.35 | 1.60 | 0.50 | 0.25 | 0.49 | 0.63 | 1.93 | 0.70 | 1.79 | 2.45 | 3.99 | 3.04 | 4.04 | 0.56 | 0.50 | 0.50 | 0.54 | 0.47 | 0.49 | 0.75 | 0.73 | 0.75 | 0.79 | 0.81 | 0.82 | 1.45 | 1.51 | 1.49 | 1.82 | 1.63 | 1.80 | 1.59 | 1.22 | 1.44 | 0.79 | 0.98 | 0.97 |
| N-BENZOYL-D5-GLYCINE | ME392379 | 0.34 | 0.29 | 0.43 | 0.35 | 0.31 | 0.41 | 0.28 | 0.36 | 0.43 | 0.29 | 0.31 | 0.28 | 1.81 | 2.70 | 1.77 | 2.70 | 4.48 | 4.65 | 3.57 | 4.39 | 0.93 | 0.83 | 0.83 | 0.94 | 0.81 | 0.83 | 1.14 | 1.03 | 1.03 | 1.14 | 1.05 | 1.04 | 0.94 | 0.95 | 0.96 | 1.03 | 0.98 | 1.02 | 0.43 | 0.37 | 0.38 | 0.41 | 0.37 | 0.38 |
| FERULIC ACID | ME392307 | 0.83 | 0.82 | 0.32 | 0.45 | 0.78 | 0.15 | NA | NA | NA | 0.89 | 1.01 | 0.54 | 3.36 | 1.32 | 3.83 | 1.01 | 1.52 | 1.54 | 4.98 | 4.28 | 0.85 | 0.98 | 0.70 | NA | NA | NA | NA | NA | NA | 0.72 | 0.40 | 0.30 | 0.68 | 0.38 | 0.38 | 0.42 | 0.24 | 0.22 | NA | NA | NA | 0.67 | 0.44 | 0.42 |
| 2-(4-HYDROXYPHENYL)PROPIONIC ACID | ME392171 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.33 | 0.83 | 0.28 | 5.12 | 0.04 | 3.16 | 0.08 | 0.99 | 0.61 | 5.49 | 0.02 | 0.07 | 1.34 | 0.05 | 0.05 | 0.71 | 0.04 | NA | NA | NA | 1.63 | 1.96 | 0.38 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.64 | 0.15 | 0.49 |
| RIBOFLAVIN | ME392426 | 0.11 | 0.29 | 0.02 | 0.09 | 0.22 | 0.02 | NA | NA | NA | 0.05 | 0.04 | 0.08 | 6.44 | 0.30 | 4.48 | 0.14 | 0.11 | 0.44 | 4.51 | 1.78 | 1.86 | 1.47 | 0.15 | 0.94 | 1.45 | 0.04 | NA | NA | NA | 1.74 | 2.05 | 1.57 | NA | NA | NA | NA | NA | NA | 0.07 | 0.06 | 0.03 | 0.23 | 0.30 | 0.13 |
| ERYTHRITOL, THREITOL | ME392304 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.22 | 0.20 | 0.26 | 2.25 | 0.03 | 4.77 | 0.04 | NA | NA | 3.73 | 0.89 | 0.06 | 0.48 | 0.06 | 0.73 | 0.92 | 0.42 | NA | NA | NA | 2.74 | 2.57 | 2.02 | 1.28 | 0.52 | 0.27 | 1.98 | 0.63 | 0.23 | NA | NA | NA | 0.37 | 0.29 | 0.21 |
| N-ACETYL-GLUTAMIC ACID | ME392367 | 0.48 | 0.76 | 0.01 | 0.39 | 0.99 | 0.02 | NA | NA | NA | 1.48 | 1.25 | 0.63 | 3.28 | 0.12 | 3.87 | 0.15 | 0.41 | 0.42 | 3.62 | 1.78 | NA | NA | NA | 0.36 | 0.89 | 0.09 | 0.53 | 0.44 | 0.55 | 2.28 | 1.63 | 1.90 | 0.10 | 1.10 | 0.05 | 0.35 | 2.67 | 0.07 | NA | NA | NA | 0.55 | 0.63 | 0.58 |
| LUMICHROME | ME392351 | NA | NA | NA | NA | NA | NA | 0.49 | 0.41 | 1.15 | 1.76 | 2.41 | 1.76 | 2.77 | 0.04 | 1.63 | 0.05 | NA | NA | 2.42 | 1.01 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.41 | 0.58 | 0.22 | 1.14 | 0.42 | 0.09 | 0.37 | 0.28 | 0.24 | 2.07 | 1.04 | 1.05 |
| PANTOTHENIC ACID | ME392400 | 0.27 | 0.49 | 0.07 | 0.16 | 0.38 | 0.04 | 0.13 | 0.18 | 0.15 | 1.46 | 1.51 | 1.54 | 3.03 | 0.19 | 3.65 | 0.21 | 0.46 | 0.52 | NA | NA | NA | NA | NA | 0.24 | 0.59 | 0.25 | 0.17 | 0.17 | 0.14 | 3.45 | 3.07 | 1.79 | NA | NA | NA | NA | NA | NA | 0.21 | 0.17 | 0.16 | 2.01 | 1.61 | 1.49 |
| CITRIC ACID | ME392278 | 0.04 | 0.02 | 0.01 | 0.00 | 0.00 | 0.00 | 0.26 | 0.32 | 0.40 | 0.75 | 0.30 | 0.03 | NA | NA | NA | NA | 1.34 | 1.18 | 8.20 | 0.83 | NA | NA | NA | NA | NA | NA | 0.65 | 0.61 | 0.59 | 3.32 | 2.44 | 2.40 | NA | NA | NA | NA | NA | NA | 0.48 | 0.29 | 0.35 | 0.83 | 0.32 | 0.95 |
| ISOVALERYLGLYCINE | ME392345 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.02 | 0.01 | 0.02 | 2.05 | 0.87 | 1.19 | 0.01 | 0.01 | 0.01 | 0.01 | 0.14 | 0.17 | 5.44 | 6.82 | NA | NA | NA | 0.02 | 0.03 | 0.02 | 0.09 | 0.06 | 0.07 | 5.02 | 4.76 | 2.68 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.04 | 0.02 | 0.06 | 2.36 | 1.13 | 3.36 |
| TAURINE | ME392444 | 0.08 | 0.14 | 0.03 | 0.07 | 0.19 | 0.07 | 0.32 | 0.17 | 0.29 | 2.07 | 1.40 | 1.50 | 0.29 | 0.13 | 0.23 | 0.08 | 0.79 | 1.20 | 4.07 | 4.47 | 0.34 | 0.78 | 0.48 | 0.04 | 0.18 | 0.05 | 2.09 | 1.73 | 1.99 | 3.04 | 3.25 | 3.29 | 0.19 | 0.26 | 0.14 | 0.20 | 0.11 | 0.10 | 0.51 | 0.45 | 0.50 | 3.00 | 2.22 | 3.74 |
| ALLANTOIN | ME392249 | 0.22 | 0.19 | 0.08 | 0.34 | 0.23 | 0.09 | 0.07 | 0.09 | 0.07 | 1.42 | 1.79 | 1.49 | 0.00 | 0.20 | 0.01 | 0.27 | 0.29 | 0.23 | 0.81 | 2.00 | 0.44 | 1.13 | 0.27 | 0.52 | 1.65 | 0.37 | 0.40 | 0.34 | 0.38 | 4.93 | 4.20 | 4.27 | 0.54 | 0.28 | 0.19 | 1.00 | 0.36 | 0.30 | 0.15 | 0.12 | 0.16 | 1.55 | 1.65 | 1.60 |
| CREATINE | ME392283 | 0.17 | 0.31 | 0.11 | 0.21 | 0.47 | 0.21 | 0.14 | 0.14 | 0.16 | 0.71 | 0.46 | 0.35 | 0.32 | 0.65 | 0.18 | 0.65 | 0.29 | 0.30 | 1.06 | 1.16 | 0.81 | 1.20 | 1.11 | 0.66 | 1.24 | 0.65 | 1.64 | 1.03 | 1.37 | 4.55 | 3.83 | 2.02 | 0.72 | 0.52 | 0.72 | 0.59 | 0.41 | 0.72 | 0.24 | 0.19 | 0.19 | 0.80 | 0.43 | 0.85 |
| TRIGONELLINE | ME392452 | 0.17 | 0.07 | 0.09 | 0.13 | 0.06 | 0.05 | 0.26 | 0.23 | 0.25 | 1.08 | 0.98 | 0.90 | 0.12 | 0.12 | 0.13 | 0.10 | 0.38 | 0.78 | 1.59 | 1.20 | 0.10 | 0.13 | 0.10 | 0.25 | 0.20 | 0.19 | 1.46 | 1.04 | 0.96 | 6.05 | 5.38 | 3.00 | 0.33 | 0.13 | 0.16 | 0.20 | 0.17 | 0.13 | 0.35 | 0.29 | 0.31 | 0.92 | 0.84 | 0.80 |
| HEXANOYLGLYCINE | ME392326 | NA | NA | NA | NA | NA | NA | 0.03 | 0.03 | 0.04 | 0.90 | 0.75 | 0.77 | NA | NA | NA | NA | 0.06 | 0.11 | 3.04 | 6.55 | NA | NA | NA | NA | NA | NA | 0.08 | 0.06 | 0.06 | 2.51 | 2.44 | 1.43 | NA | NA | NA | NA | NA | NA | 0.03 | 0.02 | 0.05 | 1.39 | 1.15 | 1.96 |
| INDOLELACTIC ACID | ME392340 | NA | NA | NA | NA | NA | NA | 0.43 | 0.29 | 0.50 | 1.70 | 0.84 | 0.77 | 0.13 | 0.04 | 0.65 | 0.04 | 1.74 | 1.80 | 2.27 | 6.46 | 0.03 | 0.52 | 0.02 | 0.06 | 0.64 | 0.06 | 0.99 | 0.62 | 0.72 | 2.32 | 2.45 | 0.95 | NA | NA | NA | NA | NA | NA | 0.76 | 0.38 | 0.79 | 2.04 | 0.97 | 1.69 |
| ADENOSINE | ME392243 | 0.23 | 0.16 | 0.15 | 0.11 | 0.14 | 0.11 | 0.65 | 2.57 | 0.30 | 1.03 | 1.07 | 1.16 | 0.63 | 0.78 | 0.71 | 1.11 | 1.92 | 0.12 | 3.02 | 3.73 | 1.33 | 0.51 | 1.28 | 1.80 | 0.31 | 1.72 | NA | NA | NA | 1.73 | 1.98 | 1.33 | 0.49 | 0.17 | 0.94 | 0.21 | 0.08 | 1.09 | 0.05 | 0.55 | 0.02 | 1.20 | 1.40 | 1.14 |
| NICOTINAMIDE | ME392387 | 0.05 | 0.04 | 0.15 | 0.14 | 0.27 | 0.15 | 0.95 | 0.94 | 1.49 | 1.07 | 0.91 | 1.30 | 0.31 | 0.66 | 0.26 | 0.34 | NA | NA | 2.64 | 2.37 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.91 | 2.40 | 1.37 | 2.00 | 0.62 | 0.61 | 1.00 | 0.13 | 0.27 | 1.32 | 1.08 | 1.00 | 1.33 | 0.97 | 1.06 |
| 4-PYRIDOXIC ACID | ME392218 | 0.29 | 0.42 | 0.17 | 0.22 | 0.39 | 0.13 | 0.09 | 0.24 | 0.05 | 1.01 | 1.24 | 1.13 | 1.55 | 0.61 | 1.54 | 0.58 | 0.73 | 0.62 | 1.66 | 1.84 | NA | NA | NA | 0.32 | 0.42 | 0.29 | 0.39 | 0.32 | 0.40 | 3.42 | 3.34 | 2.23 | 0.81 | 0.58 | 0.47 | 0.60 | 0.53 | 0.46 | NA | NA | NA | 1.60 | 1.27 | 1.26 |
| 5-HYDROXY-TRYPTOPHAN | ME392224 | 0.21 | 0.21 | 0.28 | 0.21 | 0.29 | 0.19 | 0.23 | 0.16 | 0.34 | 0.97 | 1.03 | 1.20 | 0.48 | 0.65 | 0.49 | 0.61 | 2.04 | 1.95 | 2.98 | 3.69 | 0.61 | 0.71 | 0.66 | 0.65 | 0.76 | 0.68 | 0.71 | 0.52 | 0.62 | 3.00 | 3.27 | 1.94 | 1.15 | 0.82 | 1.05 | 0.59 | 0.52 | 0.58 | NA | NA | NA | 1.06 | 0.99 | 1.06 |
| 1-METHYLNICOTINAMIDE | ME392166 | 0.10 | 0.09 | 0.07 | 0.13 | 0.14 | 0.08 | NA | NA | NA | 1.51 | 1.05 | 2.37 | 0.03 | 0.31 | 0.05 | 0.37 | NA | NA | 2.86 | 4.78 | 0.86 | 0.79 | 0.53 | 0.90 | 1.25 | 0.65 | NA | NA | NA | 2.70 | 3.07 | 2.56 | 0.33 | 0.39 | 0.37 | 0.41 | 0.46 | 0.41 | NA | NA | NA | 2.87 | 1.79 | 2.27 |
| ALPHA-N-ACETYL-GLUTAMINE | ME392254 | NA | NA | NA | NA | NA | NA | 0.05 | 0.08 | 0.08 | 1.35 | 1.80 | 1.36 | 0.00 | 0.05 | 0.04 | 0.06 | NA | NA | 1.62 | 3.04 | NA | NA | NA | NA | NA | NA | 0.10 | 0.11 | 0.10 | 2.22 | 2.18 | 1.78 | NA | NA | NA | NA | NA | NA | 0.10 | 0.08 | 0.07 | 1.13 | 2.20 | 1.35 |
| GUANOSINE | ME392323 | 0.68 | 0.77 | 1.79 | 0.33 | 0.55 | 1.74 | NA | NA | NA | 0.06 | 0.08 | 0.08 | 0.33 | 2.43 | 0.35 | 3.45 | 0.88 | 0.12 | 0.14 | 0.16 | 1.10 | 0.10 | 1.05 | 1.37 | 0.05 | 1.36 | NA | NA | NA | 0.26 | 0.36 | 0.26 | 1.45 | 0.66 | 6.61 | 0.64 | 0.30 | 7.38 | 0.13 | 0.33 | 0.30 | 0.07 | 0.07 | 0.08 |
| N-ACETYLNEURAMINATE | ME392373 | 0.21 | 0.29 | 0.23 | 0.21 | 0.31 | 0.24 | NA | NA | NA | 0.09 | 0.10 | 0.10 | 0.27 | 0.75 | 0.48 | 1.16 | NA | NA | 0.04 | 0.13 | 1.77 | 1.29 | 1.96 | 0.64 | 0.79 | 0.77 | 0.15 | 0.12 | 0.23 | 0.46 | 0.56 | 0.47 | 6.82 | 0.73 | 0.97 | 8.50 | 0.83 | 1.22 | NA | NA | NA | 0.11 | 0.10 | 0.10 |
| INOSINE | ME392344 | 0.70 | 0.93 | 0.72 | 0.73 | 1.26 | 0.74 | 0.43 | 0.33 | 0.26 | NA | NA | NA | 3.18 | 0.02 | 2.23 | 0.01 | 5.69 | 0.62 | 0.15 | 0.17 | 0.43 | 0.11 | 0.35 | 0.37 | 0.09 | 0.31 | 0.09 | 0.01 | 0.00 | NA | NA | NA | 3.94 | 2.40 | 4.10 | 1.97 | 1.26 | 3.56 | 0.59 | 1.78 | 0.27 | 0.04 | 0.05 | 0.08 |
| 2-FLUROPHENYLGLYCINE | ME392175 | 0.37 | 0.38 | 0.39 | 0.36 | 0.40 | 0.37 | 0.50 | 0.67 | 0.82 | 0.58 | 0.64 | 0.54 | 0.06 | 0.46 | 0.14 | 0.49 | NA | NA | 0.56 | 0.92 | 0.46 | 0.43 | 0.39 | 0.47 | 0.44 | 0.44 | 0.67 | 0.60 | 0.58 | 0.22 | 0.20 | 0.17 | 5.63 | 5.34 | 5.32 | 5.69 | 5.45 | 4.98 | 0.46 | 0.43 | 0.38 | 0.46 | 0.53 | 0.55 |
| 4-CHLORO-PHENYLALANINE | ME392209 | 0.20 | 0.20 | 0.22 | 0.19 | 0.21 | 0.20 | 0.35 | 0.47 | 0.57 | 0.33 | 0.36 | 0.31 | 0.20 | 0.37 | 0.25 | 0.37 | 1.09 | 1.13 | 1.04 | 1.10 | 0.71 | 0.64 | 0.63 | 0.74 | 0.59 | 0.64 | 1.71 | 1.41 | 1.52 | 1.56 | 1.44 | 1.37 | 3.44 | 3.54 | 3.40 | 3.29 | 3.40 | 2.97 | 0.46 | 0.40 | 0.42 | 0.38 | 0.35 | 0.38 |
| N-ACETYL-TYROSINE | ME392371 | NA | NA | NA | NA | NA | NA | 0.10 | 0.16 | 0.16 | 0.43 | 5.82 | 0.33 | 0.21 | 0.07 | 0.38 | 0.05 | 0.79 | 0.72 | 1.27 | 0.62 | NA | NA | NA | NA | NA | NA | 0.22 | 0.35 | 0.42 | 1.41 | 1.69 | 0.85 | NA | NA | NA | NA | NA | NA | 0.26 | 0.25 | 0.25 | 0.24 | 10.12 | 0.22 |
| N-(CINNAMOYL)GLYCINE | ME392364 | 0.65 | 0.48 | 0.58 | 0.64 | 0.44 | 0.89 | 0.02 | 0.17 | 0.03 | 0.28 | 9.79 | 0.24 | 0.17 | 1.05 | 0.33 | 0.78 | 0.90 | 0.03 | NA | NA | 0.87 | 1.29 | 0.81 | 0.60 | 0.30 | 0.32 | NA | NA | NA | 0.16 | 0.14 | 0.14 | 1.84 | 1.45 | 1.48 | 0.27 | 0.61 | 0.49 | 0.04 | 0.35 | 0.04 | 0.20 | 15.06 | 0.23 |
| HIPPURIC ACID | ME392327 | NA | NA | NA | NA | NA | NA | 0.01 | 0.09 | 0.01 | 0.36 | 7.42 | 0.28 | NA | NA | NA | NA | 0.34 | 0.05 | 11.61 | 1.06 | NA | NA | NA | NA | NA | NA | 0.04 | 0.02 | 0.05 | 0.85 | 0.81 | 0.44 | 0.00 | 0.02 | 0.00 | 0.00 | 0.01 | 0.00 | 0.01 | 0.14 | 0.01 | 0.35 | 10.20 | 0.28 |
| N-ACETYL-PHENYLALANINE | ME392370 | NA | NA | NA | NA | NA | NA | 0.33 | 0.26 | 0.47 | 0.16 | 2.96 | 0.13 | 0.11 | 0.11 | 0.32 | 0.12 | 0.60 | 0.04 | 17.33 | 0.30 | NA | NA | NA | 0.26 | 0.28 | 0.20 | 1.19 | 0.97 | 0.94 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.50 | 0.28 | 0.37 | 0.09 | 2.82 | 0.08 |
Factors:
| F1 | Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et |
| F2 | Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et |
| F3 | Experiment:community | Sample_type:caecal | Colonization:germ-free |
| F4 | Experiment:community | Sample_type:feces | Colonization:Bt_Ca_Er_Pd_Et |
| F5 | Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et |
| F6 | Experiment:community | Sample_type:feces | Colonization:germ-free |
| F7 | Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et |
| F8 | Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et |
| F9 | Experiment:community | Sample_type:serum | Colonization:germ-free |
| F10 | Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et |
| F11 | Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et |
| F12 | Experiment:community | Sample_type:urine | Colonization:germ-free |
| F13 | Experiment:conventional | Sample_type:caecal | Colonization:conventional |
| F14 | Experiment:conventional | Sample_type:caecal | Colonization:germ-free |
| F15 | Experiment:conventional | Sample_type:feces | Colonization:conventional |
| F16 | Experiment:conventional | Sample_type:feces | Colonization:germ-free |
| F17 | Experiment:conventional | Sample_type:serum | Colonization:conventional |
| F18 | Experiment:conventional | Sample_type:serum | Colonization:germ-free |
| F19 | Experiment:conventional | Sample_type:urine | Colonization:conventional |
| F20 | Experiment:conventional | Sample_type:urine | Colonization:germ-free |
| F21 | Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As |
| F22 | Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp |
| F23 | Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free |
| F24 | Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As |
| F25 | Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp |
| F26 | Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free |
| F27 | Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As |
| F28 | Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp |
| F29 | Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free |
| F30 | Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As |
| F31 | Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp |
| F32 | Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free |
| F33 | Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt |
| F34 | Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs |
| F35 | Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free |
| F36 | Experiment:mono-colonization | Sample_type:feces | Colonization:Bt |
| F37 | Experiment:mono-colonization | Sample_type:feces | Colonization:Cs |
| F38 | Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free |
| F39 | Experiment:mono-colonization | Sample_type:serum | Colonization:Bt |
| F40 | Experiment:mono-colonization | Sample_type:serum | Colonization:Cs |
| F41 | Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free |
| F42 | Experiment:mono-colonization | Sample_type:urine | Colonization:Bt |
| F43 | Experiment:mono-colonization | Sample_type:urine | Colonization:Cs |
| F44 | Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free |
