Clustering data with hclust algorithm for (Study ST001978)
HILIC UNSPECIFIED ION MODE (Analysis AN003226)| 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 | F54 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| creatine | ME456971 | 0.63 | 1.04 | 1.04 | 1.33 | 0.17 | 1.09 | 1.17 | 1.13 | 1.16 | 1.00 | 1.24 | 1.25 | 0.64 | 1.43 | 1.55 | 1.44 | 1.18 | 1.26 | 1.07 | 1.54 | 1.68 | 0.84 | 1.57 | 2.17 | 1.14 | 1.25 | 1.15 | 1.15 | 1.28 | 1.98 | 0.18 | 1.31 | 1.26 | 1.06 | 0.98 | 1.45 | 1.24 | 1.30 | 1.13 | 1.09 | 1.38 | 0.87 | 1.18 | 0.98 | 1.26 | 1.32 | 1.16 | 1.24 | 1.29 | 1.30 | 0.16 | 1.21 | 1.39 | 1.06 |
| glucose | ME457004 | 0.85 | 0.95 | 0.83 | 1.62 | 0.20 | 1.03 | 0.45 | 0.71 | 2.40 | 2.17 | 1.11 | 0.76 | 0.66 | 0.92 | 0.77 | 0.87 | 0.96 | 1.18 | 1.14 | 0.79 | 1.70 | 1.44 | 0.94 | 1.50 | 0.94 | 1.15 | 0.74 | 1.08 | 0.84 | 0.37 | 0.07 | 1.13 | 0.88 | 1.19 | 1.15 | 0.98 | 0.83 | 0.99 | 1.02 | 1.62 | 0.84 | 0.55 | 1.07 | 0.82 | 1.21 | 0.89 | 0.94 | 0.71 | 1.88 | 1.77 | 0.16 | 1.65 | 0.93 | 1.85 |
| acetylaspartate | ME456926 | 0.75 | 0.35 | NA | 0.49 | 0.46 | NA | 0.72 | 0.65 | 1.69 | 1.54 | 2.35 | 2.85 | 1.96 | 3.22 | 2.03 | 0.44 | 0.80 | 0.30 | 0.58 | 0.51 | 4.22 | 0.24 | 0.59 | 0.38 | 0.67 | 0.42 | 0.31 | 0.89 | 0.52 | 1.39 | NA | NA | 0.45 | 0.41 | 0.68 | 0.22 | 0.83 | 0.55 | 0.78 | 0.31 | 0.44 | 0.67 | 2.36 | 2.81 | 2.55 | 0.55 | 0.30 | 0.33 | 0.87 | 0.46 | 0.28 | 2.08 | 0.17 | 4.08 |
| glycerate | ME457009 | 0.78 | 0.95 | 0.74 | 1.25 | 0.94 | 1.11 | 1.22 | 0.96 | 1.15 | 1.08 | 1.11 | 1.16 | 0.99 | 1.02 | 1.03 | 1.08 | 0.98 | 1.05 | 0.92 | 1.53 | 1.50 | 1.02 | 1.69 | 1.17 | 1.19 | 1.12 | 1.24 | 1.20 | 1.22 | 1.07 | 0.94 | 1.12 | 1.07 | 0.96 | 0.97 | 1.09 | 0.90 | 1.06 | 0.97 | 0.98 | 1.09 | 0.98 | 0.97 | 1.00 | 1.08 | 0.95 | 0.92 | 0.98 | 1.13 | 1.10 | 0.79 | 0.98 | 1.00 | 0.98 |
| 2-oxoadipate_unc | ME456914 | 0.70 | 0.41 | 0.21 | 0.39 | 0.23 | NA | 0.20 | 0.45 | 4.84 | 3.11 | 2.01 | 0.37 | 2.34 | 3.71 | 3.46 | 0.34 | 0.60 | 0.42 | 0.36 | 0.48 | 0.58 | 0.30 | 0.73 | 0.38 | 0.39 | 0.61 | 0.55 | 0.40 | 0.54 | 0.28 | 0.38 | 0.33 | 0.37 | 0.33 | 0.40 | 0.34 | 0.38 | 0.26 | 0.38 | 0.62 | 0.49 | 0.47 | 2.75 | 2.56 | 0.45 | 0.58 | 0.61 | 0.46 | 0.56 | 0.24 | 0.28 | 4.20 | 0.52 | 10.10 |
| alanine | ME456937 | 0.81 | 0.81 | 0.77 | 1.21 | 0.12 | 0.87 | 0.90 | 0.99 | 1.22 | 0.98 | 1.30 | 1.15 | 0.57 | 1.30 | 1.45 | 1.11 | 0.92 | 1.11 | 0.90 | 1.37 | 1.59 | 0.73 | 1.40 | 2.03 | 1.06 | 1.19 | 1.11 | 1.08 | 1.26 | 1.32 | 0.16 | 1.15 | 0.91 | 0.98 | 0.86 | 1.17 | 0.93 | 1.12 | 0.83 | 0.92 | 1.06 | 0.74 | 1.28 | 1.00 | 1.36 | 1.09 | 0.94 | 1.03 | 1.26 | 1.24 | 0.11 | 1.18 | 1.86 | 1.18 |
| aspartate-13C6-15N4 | ME456950 | 0.84 | 0.64 | 0.45 | 1.39 | 1.41 | 1.32 | 1.31 | 1.31 | 0.79 | 0.73 | 0.74 | 0.71 | 0.73 | 0.72 | 0.79 | 0.73 | 0.71 | 0.69 | 0.76 | 1.10 | 0.91 | 0.72 | 0.54 | 0.70 | 0.78 | 0.74 | 0.73 | 0.83 | 0.80 | 1.33 | 1.25 | 1.22 | 1.15 | 1.27 | 1.32 | 1.26 | 1.18 | 1.20 | 1.24 | 1.29 | 1.30 | 1.40 | 1.31 | 1.28 | 1.35 | 1.25 | 1.25 | 1.29 | 1.30 | 1.33 | 1.11 | 1.29 | 1.29 | 1.34 |
| carnitine | ME456960 | 0.64 | 0.52 | 0.49 | 0.96 | 0.10 | 0.72 | 0.99 | 1.02 | 0.57 | 0.45 | 3.76 | 1.61 | 0.83 | 2.04 | 6.57 | 0.69 | 0.61 | 0.54 | 0.73 | 1.78 | 1.75 | 1.06 | 1.08 | 1.59 | 0.65 | 0.61 | 0.89 | 0.92 | 1.10 | 0.75 | 0.09 | 0.82 | 0.48 | 0.53 | 0.51 | 0.49 | 0.36 | 0.84 | 0.35 | 0.49 | 0.75 | 1.24 | 3.74 | 3.78 | 2.64 | 0.76 | 0.54 | 0.60 | 1.01 | 1.01 | 0.09 | 0.38 | 3.37 | 0.34 |
| 3-phosphoglycerate | ME456919 | 0.63 | 0.40 | 0.52 | 0.73 | NA | 0.31 | 0.06 | 0.15 | 1.69 | 1.53 | 1.73 | 1.57 | 0.87 | 1.98 | 1.30 | 0.18 | 0.31 | 1.07 | 0.68 | 1.00 | 5.02 | 0.65 | 0.14 | 0.75 | 0.70 | 1.55 | 0.70 | 0.68 | 0.62 | 3.12 | NA | 0.49 | 0.58 | 0.75 | 1.18 | 1.04 | 0.77 | 0.56 | 0.89 | 0.75 | 0.50 | 0.15 | 1.74 | 2.05 | 1.84 | 0.31 | 0.55 | 0.40 | 1.14 | 0.86 | NA | 2.95 | 1.15 | 4.96 |
| anserine_unc | ME456944 | 0.85 | 0.24 | 0.21 | 0.09 | 0.01 | 0.10 | 0.04 | 0.03 | 0.29 | 0.46 | 5.60 | 3.95 | 1.80 | 5.78 | 6.04 | 0.20 | 0.11 | 0.21 | 0.13 | 0.19 | 0.38 | 0.41 | 0.15 | 0.43 | 0.22 | 0.33 | 0.29 | 0.35 | 0.49 | 0.43 | NA | 0.13 | 0.26 | 0.24 | 0.23 | 0.21 | 0.03 | 0.32 | 0.72 | 0.02 | 0.39 | 0.49 | 6.64 | 5.31 | 6.57 | 0.58 | 0.85 | 0.81 | 0.09 | 0.09 | NA | 0.15 | 0.17 | 0.17 |
| ascorbate_unc | ME456948 | 1.07 | 0.38 | 0.41 | 0.31 | 0.10 | 0.86 | 0.18 | 1.77 | 0.54 | 0.38 | 0.30 | 0.35 | 0.60 | 1.01 | 1.09 | 0.78 | 1.75 | 0.39 | 1.76 | 0.46 | 0.47 | 1.84 | 0.58 | 0.08 | 0.39 | 0.39 | 0.41 | 0.45 | 2.41 | 1.00 | 0.42 | 0.64 | 0.55 | 2.72 | 2.05 | 0.65 | 2.71 | 0.67 | 1.25 | 2.33 | 0.82 | 0.25 | 0.59 | 0.53 | 0.57 | 1.86 | 3.02 | 2.09 | 0.68 | 0.61 | 0.56 | 2.82 | 0.93 | 1.01 |
| Glucose 6-phosphate | ME457003 | 0.74 | 1.22 | 1.20 | 1.32 | NA | 0.67 | 0.93 | 1.40 | 0.85 | 0.59 | 0.89 | 0.68 | 0.58 | 0.53 | 0.71 | 0.31 | 0.33 | 0.88 | 0.63 | 2.43 | 2.44 | 0.94 | 0.72 | 1.42 | 0.96 | 0.78 | 1.14 | 0.79 | 1.07 | 7.19 | NA | 1.30 | 1.39 | 0.21 | 1.37 | 1.02 | 0.55 | 1.22 | 1.09 | 0.59 | 0.60 | 0.75 | 0.64 | 1.14 | 0.72 | 0.58 | 0.29 | 0.38 | 1.73 | 1.36 | NA | 1.06 | 2.00 | 0.52 |
| glutamate-13C5,15N | ME457005 | 0.84 | 0.66 | 0.48 | 1.31 | 1.39 | 1.27 | 1.22 | 1.18 | 0.77 | 0.72 | 0.74 | 0.69 | 0.75 | 0.76 | 0.76 | 0.69 | 0.68 | 0.66 | 0.66 | 0.99 | 0.86 | 0.68 | 0.57 | 0.77 | 0.76 | 0.70 | 0.69 | 0.72 | 0.81 | 1.43 | 1.37 | 1.28 | 1.17 | 1.34 | 1.27 | 1.31 | 1.23 | 1.25 | 1.30 | 1.33 | 1.31 | 1.35 | 1.37 | 1.34 | 1.35 | 1.23 | 1.22 | 1.33 | 1.38 | 1.29 | 1.19 | 1.35 | 1.29 | 1.33 |
| aspartate | ME456951 | 0.71 | 0.60 | 0.53 | 1.49 | 0.46 | 0.94 | 3.56 | 2.21 | NA | NA | 0.44 | 0.83 | NA | 0.62 | 0.93 | 0.55 | NA | 1.02 | 0.61 | 1.24 | 1.86 | 2.04 | 1.99 | 0.71 | 1.03 | 0.91 | 0.68 | 0.86 | 1.30 | 2.54 | 1.01 | 1.01 | 1.03 | 1.09 | 0.62 | 0.59 | 0.50 | NA | 0.77 | 0.99 | 1.72 | 3.58 | 1.32 | 0.39 | 1.02 | 0.66 | 0.70 | 0.53 | 1.46 | 1.36 | 0.40 | 0.67 | 0.53 | NA |
| cis-aconitate | ME456965 | 0.85 | 0.73 | 0.88 | 1.10 | 0.11 | 0.90 | 0.92 | 0.89 | 1.23 | 1.11 | 1.70 | 1.67 | 0.94 | 1.93 | 1.64 | 0.97 | 0.76 | 1.17 | 0.90 | 1.27 | 2.22 | 0.97 | 0.99 | 1.47 | 1.10 | 1.13 | 0.89 | 0.96 | 0.99 | 0.13 | 0.13 | 0.81 | 0.77 | 0.77 | 0.81 | 0.97 | 0.88 | 0.98 | 0.86 | 0.90 | 0.94 | 0.80 | 1.63 | 1.45 | 1.57 | 1.06 | 1.00 | 1.05 | 1.06 | 1.04 | 0.14 | 1.20 | 1.45 | 1.45 |
| adenine | ME456931 | 0.69 | 0.41 | 0.15 | 0.61 | 0.16 | NA | 0.79 | NA | 0.39 | 0.81 | 0.13 | 0.37 | 0.24 | 0.29 | 0.38 | NA | NA | NA | 0.11 | 1.53 | 0.77 | 0.21 | 0.57 | NA | 0.18 | 0.23 | 0.09 | NA | NA | 31.39 | 0.17 | 0.70 | 0.53 | 0.44 | 0.13 | 0.41 | 0.15 | 0.15 | 0.12 | 0.07 | 0.42 | 0.46 | 0.27 | 0.36 | 0.47 | 0.42 | NA | NA | 0.67 | 0.70 | 0.32 | 0.28 | 0.24 | 0.29 |
| arginine-13C6-15N4 | ME456945 | 0.78 | 0.73 | 0.56 | 1.20 | 1.83 | 1.21 | 0.79 | 0.88 | 0.87 | 0.86 | 0.57 | 0.66 | 0.93 | 0.64 | 0.62 | 0.69 | 0.75 | 0.69 | 0.75 | 0.83 | 0.73 | 0.76 | 0.53 | 0.56 | 0.80 | 0.69 | 0.69 | 0.66 | 0.85 | 1.36 | 1.41 | 1.44 | 1.68 | 1.37 | 1.44 | 1.36 | 1.36 | 1.28 | 1.46 | 1.42 | 1.24 | 1.59 | 1.18 | 1.25 | 1.16 | 1.36 | 1.40 | 1.44 | 1.28 | 1.33 | 1.96 | 1.29 | 1.05 | 1.48 |
| C5 Carnitines | ME456958 | 0.72 | 0.35 | 0.61 | 0.64 | 0.06 | 0.67 | 1.02 | 0.93 | 1.30 | 0.91 | 3.66 | 1.79 | 0.81 | 2.30 | 6.75 | 1.12 | 0.71 | 0.60 | 0.77 | 1.19 | 1.17 | 1.01 | 0.84 | 1.63 | 0.42 | 0.53 | 0.58 | 0.69 | 0.98 | 0.44 | 0.06 | 0.47 | 0.29 | 0.39 | 0.47 | 0.35 | 0.29 | 0.94 | 0.24 | 0.45 | 0.78 | 1.29 | 3.73 | 3.84 | 2.93 | 0.82 | 0.48 | 0.39 | 0.69 | 0.67 | 0.06 | 0.15 | 3.03 | 0.25 |
| betaine | ME456955 | 0.83 | 0.66 | 0.71 | 0.61 | 0.10 | 0.65 | 0.91 | 0.65 | 1.40 | 1.17 | 2.54 | 1.36 | 0.66 | 2.32 | 3.95 | 0.66 | 0.71 | 0.69 | 0.72 | 1.89 | 2.38 | 1.16 | 0.82 | 1.23 | 0.96 | 0.99 | 1.13 | 1.25 | 1.34 | 0.39 | 0.08 | 0.42 | 0.46 | 0.64 | 0.57 | 0.54 | 0.50 | 0.78 | 0.40 | 0.83 | 0.68 | 0.41 | 2.43 | 2.12 | 1.78 | 1.14 | 1.14 | 1.07 | 0.65 | 0.61 | 0.10 | 1.05 | 2.01 | 1.21 |
| cytidine | ME456980 | 0.75 | 0.12 | 0.14 | 0.14 | 0.02 | 0.13 | 0.07 | 0.06 | 7.60 | 7.73 | 0.18 | 0.06 | 0.02 | 0.07 | 0.10 | 0.22 | 0.23 | 0.13 | 0.14 | 0.20 | 11.40 | 0.12 | 0.18 | 0.24 | 0.36 | 0.81 | 0.18 | 0.23 | 0.24 | 2.08 | NA | 0.18 | 0.13 | 0.15 | 0.16 | 0.20 | 0.16 | 0.26 | 0.16 | 0.20 | 0.16 | 0.01 | 0.18 | 0.13 | 0.15 | 0.17 | 0.20 | 0.20 | 0.16 | 0.15 | 0.02 | 7.29 | 0.32 | 12.36 |
| glutamate | ME457006 | 0.74 | 0.53 | 0.62 | 1.09 | NA | NA | 3.59 | 1.13 | 1.15 | 1.50 | 1.02 | 0.83 | 0.45 | 0.44 | 0.84 | 0.38 | 0.39 | 0.65 | NA | 1.26 | 1.47 | 0.49 | 1.13 | 0.55 | 1.01 | 0.75 | 0.56 | 0.57 | NA | 3.58 | NA | 2.62 | 2.54 | NA | 0.50 | 0.64 | NA | 0.64 | 1.18 | NA | 0.68 | 1.44 | 1.01 | 1.50 | 1.66 | NA | 0.40 | 0.40 | 1.25 | 1.34 | 0.21 | NA | 1.42 | NA |
| cystine | ME456979 | 0.83 | 0.47 | 0.33 | 0.79 | NA | 1.02 | 1.43 | 2.07 | 1.76 | 1.01 | 1.08 | 1.20 | 0.47 | 0.68 | 5.39 | 0.44 | 0.28 | 0.64 | 0.68 | 0.85 | 2.29 | 0.73 | 0.19 | 1.23 | 0.67 | 1.54 | 0.67 | 0.65 | 1.25 | 0.61 | NA | NA | 0.10 | 0.46 | 0.17 | 0.31 | 0.37 | 0.31 | 0.27 | 0.49 | 0.87 | 1.05 | 1.38 | 1.48 | 1.24 | 2.04 | 0.69 | 0.39 | 1.08 | 1.25 | NA | 1.11 | 4.93 | 1.37 |
| Fructose 1,6-bisphosphate | ME456996 | 0.89 | 0.74 | 0.61 | 1.80 | NA | 1.88 | 3.09 | 2.02 | 0.82 | 1.05 | 0.19 | 0.29 | 0.39 | 0.19 | 1.13 | 1.75 | 1.58 | 0.73 | 0.87 | 1.80 | 1.87 | 1.13 | 1.29 | 1.98 | 0.62 | 1.52 | 1.20 | 1.13 | 2.18 | 0.10 | NA | 0.46 | 0.65 | 0.37 | 0.30 | 0.56 | 0.92 | 1.28 | 0.40 | 1.07 | 1.01 | 0.57 | 0.67 | 0.18 | 0.12 | 1.04 | 0.83 | 0.88 | 1.28 | 1.48 | NA | 1.34 | 1.33 | 0.74 |
| asymmetric dimethylarginine (ADMA) | ME456952 | 0.82 | 0.47 | 0.58 | 0.66 | 0.08 | 0.84 | 0.69 | 0.64 | 0.87 | 0.85 | 2.34 | 1.40 | 0.61 | 1.77 | 2.02 | 0.74 | 0.52 | 0.78 | 0.67 | 1.02 | 1.26 | 0.89 | 0.87 | 0.93 | 1.01 | 0.72 | 0.98 | 1.17 | 1.74 | 0.40 | 0.07 | 0.73 | 0.89 | 0.79 | 0.90 | 0.65 | 0.60 | 0.62 | 0.60 | 0.89 | 0.93 | 2.06 | 2.35 | 1.79 | 1.72 | 0.87 | 0.94 | 1.17 | 0.66 | 0.68 | 0.07 | 1.08 | 5.74 | 1.49 |
| argininosuccinate_unc | ME456947 | 0.87 | 0.95 | 1.13 | 1.28 | 0.14 | 1.04 | 1.14 | 0.56 | 0.87 | 0.68 | 0.70 | 0.61 | 0.34 | 0.66 | 0.81 | 1.23 | 1.34 | 1.16 | 1.32 | 1.89 | 1.03 | 1.15 | 1.70 | 2.60 | 0.67 | 1.14 | 1.00 | 1.02 | 0.98 | 1.93 | 0.05 | 1.15 | 1.13 | 0.95 | 1.04 | 1.41 | 1.06 | 1.49 | 1.26 | 1.26 | 1.90 | 0.67 | 0.81 | 0.46 | 0.90 | 0.86 | 0.98 | 1.15 | 1.42 | 1.38 | 0.14 | 1.02 | 1.00 | 0.60 |
| F6P_G1P_unc | ME456992 | 0.76 | 0.65 | 0.79 | 1.20 | NA | 0.99 | 2.01 | 1.37 | 0.68 | 0.63 | 0.30 | 0.46 | 0.20 | 0.37 | 0.32 | 1.04 | 1.37 | 0.84 | 1.13 | 2.66 | 1.97 | 1.79 | 1.12 | 2.33 | 1.08 | 1.36 | 2.07 | 1.72 | 2.35 | 1.35 | NA | 1.14 | 0.95 | 0.38 | 0.66 | 0.72 | 0.77 | 0.94 | 0.84 | 1.00 | 0.96 | 0.78 | 0.50 | 0.46 | 0.47 | 0.70 | 0.67 | 0.74 | 1.38 | 1.65 | NA | 1.47 | 1.79 | 0.45 |
| 2-hydroxyglutarate | ME456913 | 0.76 | 1.11 | 0.93 | 1.09 | 1.17 | 1.07 | 1.00 | 1.01 | 1.00 | 0.91 | 0.90 | 0.92 | 1.13 | 0.93 | 1.06 | 1.11 | 0.85 | 0.92 | 0.86 | 1.10 | 1.19 | 0.89 | 1.56 | 0.84 | 0.83 | 1.01 | 0.98 | 0.76 | 0.92 | 1.09 | 1.28 | 1.31 | 0.92 | 1.10 | 1.30 | 1.21 | 1.27 | 1.29 | 1.08 | 1.28 | 1.10 | 1.13 | 1.20 | 1.12 | 1.12 | 1.08 | 1.12 | 1.12 | 1.20 | 1.11 | 1.20 | 1.32 | 1.10 | 1.17 |
| 3-methyl-2-oxopentanoic_acid | ME456918 | 0.74 | NA | 0.16 | 0.06 | NA | 1.05 | 0.39 | 0.98 | 3.10 | 3.03 | 1.43 | 0.36 | 0.65 | 1.05 | 1.86 | 1.65 | 1.25 | 1.04 | 1.48 | 0.24 | 1.25 | 1.83 | 0.23 | 1.68 | 0.75 | 0.29 | 0.10 | 0.07 | 1.12 | 0.09 | NA | 0.07 | NA | 1.47 | 1.19 | NA | 1.21 | 0.09 | 0.61 | 1.83 | 1.45 | 1.57 | 1.81 | 1.86 | 0.72 | 1.48 | 1.09 | 1.02 | 0.08 | 0.09 | NA | 1.41 | 2.75 | 2.08 |
| formyl_methionine | ME456995 | 0.69 | 0.40 | 0.54 | 0.40 | NA | 0.49 | 0.86 | 0.92 | 2.79 | 1.85 | 1.35 | 0.91 | 0.64 | 1.69 | 2.39 | 1.93 | 1.72 | 1.11 | 1.11 | 1.45 | 2.80 | 1.84 | 0.58 | 1.35 | 0.70 | 0.63 | 0.76 | 0.53 | 1.61 | 0.24 | NA | 0.44 | 0.08 | 0.64 | 0.32 | 0.47 | 0.73 | 0.89 | 0.56 | 1.59 | 1.15 | 0.26 | 1.49 | 1.25 | 0.82 | 0.75 | 1.62 | 1.62 | 0.49 | 0.51 | NA | 1.97 | 2.44 | 1.37 |
| Butyrylcarnitine | ME456957 | 0.73 | 0.60 | 0.57 | 0.61 | 0.06 | 0.75 | 1.10 | 1.03 | 0.69 | 0.56 | 3.02 | 1.34 | 0.67 | 1.61 | 4.74 | 0.97 | 0.85 | 0.87 | 0.80 | 1.40 | 1.29 | 0.92 | 0.92 | 1.98 | 0.49 | 0.53 | 0.81 | 0.69 | 1.51 | 1.21 | 0.07 | 0.70 | 0.39 | 0.54 | 0.41 | 0.50 | 0.39 | 1.01 | 0.35 | 0.84 | 0.81 | 1.29 | 3.04 | 2.71 | 2.42 | 0.75 | 0.45 | 0.49 | 0.65 | 0.71 | 0.05 | 0.38 | 5.61 | 0.24 |
| acetylserine | ME456930 | 0.81 | 0.98 | 1.19 | 1.09 | 0.17 | 1.02 | 1.76 | 1.52 | 1.08 | 1.13 | 0.58 | 0.76 | 0.37 | 0.76 | 0.59 | 1.58 | 1.56 | 1.13 | 1.25 | 1.63 | 1.20 | 1.52 | 1.11 | 1.60 | 1.10 | 1.53 | 1.27 | 1.34 | 1.35 | 0.29 | 0.13 | 1.43 | 0.86 | 0.86 | 0.81 | 1.26 | 0.93 | 1.31 | 1.13 | 1.18 | 1.30 | 1.14 | 0.58 | 0.57 | 0.46 | 0.97 | 1.12 | 1.09 | 1.18 | 1.15 | 0.17 | 1.73 | 1.56 | 0.82 |
| dTTP | ME456989 | 1.13 | 2.31 | 1.72 | 1.09 | 2.45 | 1.04 | 0.76 | 0.94 | 0.93 | 1.19 | 0.09 | 0.13 | 1.65 | 0.33 | 0.61 | 0.51 | 0.71 | 0.17 | 1.09 | 0.23 | 0.16 | 0.67 | 0.10 | 0.13 | 0.59 | 1.33 | 0.51 | 0.10 | 0.17 | 0.39 | 0.20 | 0.46 | 1.03 | 0.92 | 1.71 | 1.40 | 1.39 | 0.67 | 1.67 | 2.00 | 0.69 | 0.49 | 1.54 | 1.52 | 0.98 | 1.40 | 1.41 | 1.16 | 1.42 | 1.41 | 2.73 | 1.01 | 0.31 | 1.36 |
| alanine-13C3-15N | ME456936 | 0.80 | 0.88 | 0.60 | 1.00 | 1.93 | 1.27 | 1.14 | 1.10 | 0.86 | 0.88 | 0.80 | 0.77 | 1.05 | 0.78 | 0.75 | 0.91 | 0.88 | 0.92 | 0.87 | 1.09 | 0.91 | 0.88 | 0.75 | 0.78 | 1.00 | 0.77 | 0.81 | 0.89 | 0.90 | 1.21 | 2.16 | 1.27 | 1.21 | 1.20 | 1.24 | 1.11 | 1.18 | 1.17 | 1.07 | 1.21 | 1.21 | 1.34 | 1.05 | 1.08 | 1.04 | 1.02 | 1.14 | 1.27 | 1.04 | 1.06 | 1.59 | 1.13 | 0.84 | 1.15 |
| creatinine | ME456972 | 0.71 | 1.01 | 1.15 | 1.03 | 0.17 | 1.00 | 1.50 | 1.22 | 1.26 | 1.40 | 1.22 | 1.20 | 0.62 | 1.17 | 1.32 | 1.56 | 1.39 | 1.23 | 1.17 | 1.94 | 1.94 | 1.41 | 1.34 | 1.56 | 1.14 | 1.30 | 1.41 | 1.45 | 1.56 | 0.03 | 0.13 | 1.03 | 0.90 | 0.76 | 0.86 | 0.98 | 0.94 | 1.27 | 0.85 | 1.18 | 1.29 | 0.81 | 1.25 | 1.15 | 1.11 | 0.91 | 1.08 | 1.12 | 1.10 | 1.01 | 0.14 | 1.48 | 1.32 | 0.96 |
| arginine | ME456946 | 0.67 | 0.99 | 0.85 | 1.22 | 0.20 | 0.91 | 0.68 | 0.89 | 1.15 | 0.96 | 1.46 | 1.13 | 0.81 | 1.32 | 1.71 | 0.90 | 1.01 | 1.09 | 1.05 | 1.53 | 1.59 | 1.10 | 1.42 | 1.65 | 1.01 | 1.23 | 1.14 | 0.95 | 1.09 | 1.52 | 0.12 | 0.90 | 0.77 | 1.24 | 1.16 | 1.19 | 1.17 | 1.30 | 1.14 | 1.42 | 1.09 | 0.55 | 1.73 | 1.45 | 1.51 | 1.21 | 1.10 | 1.36 | 1.31 | 1.40 | 0.22 | 1.11 | 2.16 | 1.43 |
| acetylglutamate | ME456928 | 0.73 | 0.82 | 0.82 | NA | 0.40 | 0.38 | 0.57 | 0.35 | 1.50 | 1.04 | 1.85 | 1.35 | 0.73 | 1.31 | 0.71 | 0.85 | 1.33 | 1.10 | 1.03 | 1.51 | 2.14 | 1.04 | 1.07 | 0.68 | 1.16 | 0.94 | 1.16 | 1.16 | 0.75 | 0.63 | 0.41 | 0.84 | 1.14 | 1.26 | 1.25 | 1.09 | 1.18 | 1.28 | 1.13 | 1.29 | 0.98 | NA | 1.86 | 1.65 | 1.25 | 0.41 | 1.66 | 1.06 | 0.54 | 0.84 | 0.39 | 1.90 | 1.62 | 1.94 |
| adenosine_unc | ME456932 | 0.69 | 0.01 | 0.02 | NA | NA | 0.01 | 0.02 | 0.02 | NA | NA | 0.02 | 0.01 | 0.00 | 0.03 | 0.04 | 0.01 | 0.01 | 0.01 | 0.01 | 0.02 | 0.01 | 0.04 | 0.01 | 0.03 | NA | 0.01 | 0.02 | 0.02 | 0.08 | 39.62 | NA | 0.01 | NA | NA | 0.01 | NA | 0.03 | NA | NA | 0.00 | 0.02 | 0.06 | 0.01 | NA | NA | NA | 0.02 | 0.02 | NA | NA | NA | 0.01 | 0.07 | 0.03 |
| 2-hydroxybutyric_acid | ME456912 | 0.69 | 0.50 | 0.82 | 1.56 | NA | 2.21 | 2.18 | 0.71 | 3.59 | 1.74 | 0.35 | 0.59 | 0.17 | 0.43 | 0.79 | 2.06 | 1.24 | 1.59 | 1.21 | 0.90 | 2.95 | 0.66 | 0.65 | 3.24 | 1.72 | 1.87 | 0.49 | 0.84 | 0.75 | NA | NA | 0.56 | 0.60 | 0.28 | 0.69 | 1.32 | 0.30 | 0.72 | 0.75 | 0.26 | 0.34 | 1.14 | 0.41 | 0.89 | 0.42 | 0.79 | 0.30 | 0.38 | 1.89 | 1.66 | NA | 1.31 | 1.84 | 1.61 |
| choline | ME456964 | 0.85 | 0.60 | 0.55 | 0.75 | 0.07 | 0.69 | 1.09 | 0.81 | 1.43 | 1.17 | 1.78 | 1.54 | 0.55 | 1.39 | 1.81 | 0.90 | 0.90 | 0.85 | 0.92 | 2.32 | 2.75 | 1.00 | 1.08 | 1.49 | 0.67 | 0.68 | 0.88 | 1.00 | 1.23 | 3.34 | 0.11 | 0.60 | 0.65 | 0.69 | 0.46 | 0.64 | 0.58 | 0.80 | 0.48 | 0.97 | 0.71 | 0.56 | 1.71 | 1.48 | 1.48 | 1.05 | 1.04 | 1.20 | 0.78 | 0.76 | 0.08 | 1.28 | 1.90 | 0.98 |
| 2-aminobutyric_acid | ME456911 | 0.61 | NA | NA | NA | NA | 1.32 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 2.17 | 0.79 | NA | NA | NA | NA | NA | 0.37 | 0.70 | 0.85 | 0.66 | 1.00 | 1.30 | 0.54 | 0.73 | 1.24 | 0.94 | NA | 1.00 | 1.02 | 1.99 | 1.23 | 1.54 | 0.71 | 1.12 | 1.46 | 1.24 | 0.23 | 1.46 | 1.61 | 1.53 |
| asparagine | ME456949 | 0.85 | 0.82 | 0.81 | 1.08 | 0.17 | 0.87 | 0.21 | 1.02 | 1.08 | 1.05 | 1.55 | 0.67 | 0.44 | 0.75 | 1.38 | 0.68 | 0.64 | 0.96 | 0.87 | 1.10 | 0.93 | 0.76 | 1.20 | 1.84 | 1.09 | 1.01 | 1.03 | 0.98 | 1.58 | 0.62 | 0.17 | 0.80 | 0.67 | 0.89 | 0.96 | 1.08 | 0.78 | 0.92 | 1.39 | 0.93 | 1.12 | 0.99 | 1.50 | 1.40 | 1.28 | 1.66 | 1.11 | 0.99 | 1.11 | 1.11 | 0.15 | 0.76 | 5.75 | 0.75 |
| citrate | ME456966 | 0.93 | 0.95 | 0.99 | 1.22 | 0.24 | 1.18 | 1.16 | 1.25 | 0.77 | 0.78 | 1.06 | 0.97 | 0.60 | 0.93 | 0.84 | 1.25 | 1.09 | 1.20 | 1.18 | 1.36 | 1.06 | 1.01 | 1.07 | 1.54 | 1.27 | 1.19 | 1.10 | 1.09 | 1.24 | 0.15 | 0.20 | 0.87 | 1.01 | 1.04 | 1.05 | 1.11 | 1.04 | 1.09 | 0.96 | 1.04 | 1.10 | 1.17 | 1.07 | 0.93 | 1.05 | 1.35 | 1.12 | 1.10 | 1.29 | 1.31 | 0.26 | 0.86 | 1.71 | 0.72 |
| 2-oxobutyric_acid_unc | ME456915 | 0.81 | 0.94 | 0.64 | 0.86 | 0.69 | 1.11 | 0.79 | 1.06 | 1.42 | 1.23 | 1.03 | 1.07 | 0.93 | 0.92 | 1.12 | 1.18 | 1.10 | 1.11 | 1.04 | 1.47 | 1.19 | 1.00 | 1.61 | 1.29 | 0.99 | 1.01 | 1.02 | 0.98 | 1.26 | 0.87 | 1.01 | 1.05 | 1.10 | 1.13 | 1.12 | 1.07 | 1.01 | 0.96 | 1.02 | 1.07 | 1.01 | 0.98 | 0.93 | 1.01 | 1.02 | 1.06 | 1.03 | 1.01 | 0.99 | 0.99 | 0.79 | 1.22 | 1.23 | 1.24 |
| cystathionine | ME456974 | 0.58 | 0.29 | 0.14 | 0.07 | NA | NA | 0.14 | 0.08 | 4.55 | 2.46 | 3.55 | 1.78 | 1.29 | 2.40 | 7.44 | 0.59 | 0.18 | 0.30 | 0.11 | 0.16 | 5.07 | 0.19 | 0.10 | 0.31 | 0.64 | 0.64 | 0.25 | 0.24 | 0.22 | 0.52 | NA | 0.20 | NA | 0.20 | 0.15 | 0.41 | 0.18 | 0.34 | 0.34 | 0.47 | 0.21 | 0.07 | 4.12 | 4.97 | 1.53 | 0.10 | 0.30 | 0.42 | 0.16 | 0.13 | NA | 1.73 | 0.44 | 4.46 |
| 3-ureidopropionate | ME456920 | 0.70 | 0.56 | 0.68 | 0.48 | 0.07 | 0.46 | 1.00 | 0.46 | 0.59 | 0.49 | 1.24 | 1.00 | 0.48 | 0.77 | 0.77 | 2.65 | 1.70 | 0.63 | 0.56 | 0.94 | 1.44 | 0.48 | 0.84 | 1.02 | 0.31 | 0.79 | 0.87 | 0.34 | 0.74 | 0.77 | NA | 1.04 | 0.47 | 1.53 | 1.29 | 0.65 | 2.00 | 0.95 | 2.13 | 0.56 | 0.37 | 1.82 | 2.08 | 1.22 | 1.23 | 6.67 | 2.34 | 1.14 | 1.13 | 1.12 | NA | 0.52 | 1.80 | 0.53 |
| citrulline | ME456967 | 0.90 | 0.87 | 0.67 | 0.79 | 0.15 | 0.75 | 0.93 | 1.06 | 0.51 | 0.53 | 2.43 | 1.14 | 0.75 | 1.38 | 3.01 | 0.72 | 0.68 | 0.99 | 1.09 | 1.71 | 1.13 | 1.01 | 1.28 | 1.11 | 0.84 | 0.91 | 1.30 | 1.07 | 1.57 | 0.89 | 0.10 | 0.49 | 0.59 | 0.74 | 0.60 | 0.55 | 0.54 | 0.75 | 0.78 | 0.90 | 1.33 | 1.49 | 2.49 | 1.79 | 1.75 | 1.03 | 0.82 | 1.16 | 0.81 | 0.88 | 0.15 | 0.57 | 2.23 | 0.78 |
| dihydroxyacetone_phosphate | ME456986 | 0.69 | 0.72 | 0.53 | 1.15 | NA | NA | 0.29 | 0.65 | 1.49 | 0.92 | 0.32 | 0.72 | NA | 0.68 | 1.37 | 0.28 | 0.61 | 2.14 | 0.79 | 1.52 | 3.20 | 0.95 | 0.67 | 1.67 | 0.44 | 1.00 | NA | NA | 0.47 | 1.84 | NA | NA | 0.27 | NA | 1.11 | 1.04 | 0.81 | 0.95 | 0.79 | 1.53 | 0.33 | 1.64 | NA | 0.47 | 0.50 | 1.32 | 0.83 | 0.57 | 1.68 | 1.68 | NA | 1.81 | 2.32 | 2.61 |
| acetylcarnitine | ME456927 | 0.64 | 0.36 | 0.62 | 0.57 | 0.02 | 1.41 | 0.86 | 1.54 | 0.69 | 0.49 | 4.03 | 1.20 | 0.66 | 1.36 | 5.61 | 1.01 | 0.80 | 0.71 | 0.84 | 1.09 | 0.68 | 1.35 | 0.74 | 1.87 | 0.53 | 0.67 | 0.92 | 0.86 | 2.13 | 1.19 | 0.09 | 0.09 | 0.02 | 0.52 | 0.54 | 0.18 | 0.44 | 0.95 | 0.41 | 0.73 | 0.93 | 2.53 | 4.05 | 3.62 | 1.93 | 0.99 | 0.63 | 0.59 | 0.59 | 1.01 | 0.02 | 0.35 | 4.81 | 0.21 |
| 3-hydroxyisobutyric_acid | ME456917 | 0.84 | 0.91 | 1.10 | 0.99 | 0.07 | 0.59 | 1.05 | 0.87 | 2.39 | 1.75 | 1.13 | 1.26 | 0.74 | 1.52 | 2.24 | 1.42 | 1.05 | 1.40 | 1.32 | 0.70 | 2.26 | 0.62 | 0.64 | 1.45 | 1.05 | 1.62 | 0.93 | 1.10 | 1.04 | 0.45 | 0.09 | 0.80 | 0.83 | 0.53 | 0.93 | 1.15 | 0.97 | 1.29 | 0.96 | 0.85 | 0.60 | 0.90 | 1.10 | 1.29 | 1.37 | 0.80 | 0.75 | 0.72 | 1.01 | 0.97 | 0.07 | 1.52 | 1.30 | 1.09 |
| cytosine_unc | ME456981 | 0.85 | 1.66 | 1.08 | 0.71 | 0.32 | 0.77 | 0.88 | 0.63 | 0.73 | 0.83 | 1.88 | 0.96 | 0.79 | 0.61 | 1.06 | 1.03 | 0.49 | 0.67 | 1.36 | 0.99 | 1.07 | 0.87 | 1.04 | 0.84 | 1.27 | 0.93 | 2.55 | 0.97 | 1.86 | 0.43 | 0.10 | 0.77 | 1.14 | 0.45 | 0.52 | 0.49 | 1.20 | 1.39 | 1.08 | 0.84 | 1.01 | 1.17 | 2.11 | 1.45 | 1.21 | 1.17 | 1.06 | 1.95 | 0.64 | 0.93 | 0.43 | 3.50 | 1.13 | 0.45 |
| alpha-keto-isovalerate | ME456939 | 0.78 | NA | 0.04 | NA | NA | 1.38 | 0.06 | 1.05 | 1.81 | 1.92 | 1.10 | 0.13 | 0.75 | 1.23 | 1.83 | 1.91 | 1.73 | 0.96 | 1.99 | 0.04 | 0.33 | 1.23 | 0.04 | 1.89 | 0.71 | 0.10 | 0.07 | 0.04 | 1.31 | 0.08 | NA | NA | NA | 1.50 | 1.04 | NA | 1.83 | NA | 0.55 | 1.68 | 1.33 | 1.67 | 1.07 | 1.02 | 0.22 | 1.29 | 1.46 | 1.35 | NA | NA | NA | 2.15 | 1.93 | 1.70 |
| glutamine | ME457007 | 0.64 | 0.95 | 1.00 | 1.23 | 0.26 | 1.01 | 1.10 | 1.19 | 1.38 | 1.25 | 1.53 | 1.34 | 0.89 | 1.45 | 1.68 | 1.25 | 1.14 | 1.36 | 1.27 | 1.33 | 1.37 | 1.14 | 1.21 | 1.74 | 1.11 | 1.29 | 1.21 | 1.21 | 1.34 | 0.99 | 0.25 | 0.95 | 0.81 | 1.12 | 1.12 | 1.16 | 1.07 | 1.22 | 1.00 | 1.28 | 1.21 | 0.94 | 1.51 | 1.32 | 1.39 | 1.44 | 1.41 | 1.37 | 1.18 | 1.21 | 0.24 | 1.24 | 1.44 | 1.34 |
Factors:
| F1 | Factor:- |
| F2 | Factor:L10-1 |
| F3 | Factor:L10-2 |
| F4 | Factor:L1-1 |
| F5 | Factor:L1-2 |
| F6 | Factor:L1-3 |
| F7 | Factor:L1-4 |
| F8 | Factor:L1-5 |
| F9 | Factor:L2-1 |
| F10 | Factor:L2-2 |
| F11 | Factor:L3-1 |
| F12 | Factor:L3-2 |
| F13 | Factor:L3-3 |
| F14 | Factor:L3-4 |
| F15 | Factor:L3-5 |
| F16 | Factor:L4-1 |
| F17 | Factor:L4-2 |
| F18 | Factor:L5-1 |
| F19 | Factor:L5-2 |
| F20 | Factor:L6-1 |
| F21 | Factor:L6-2 |
| F22 | Factor:L6-3 |
| F23 | Factor:L7-1 |
| F24 | Factor:L7-2 |
| F25 | Factor:L8-1 |
| F26 | Factor:L8-2 |
| F27 | Factor:L9-1 |
| F28 | Factor:L9-2 |
| F29 | Factor:L9-3 |
| F30 | Factor:mouse control |
| F31 | Factor:N25 |
| F32 | Factor:N55 |
| F33 | Factor:N58 |
| F34 | Factor:N61 |
| F35 | Factor:N66 |
| F36 | Factor:N75 |
| F37 | Factor:N88 |
| F38 | Factor:N9 |
| F39 | Factor:N91 |
| F40 | Factor:N93 |
| F41 | Factor:N95 |
| F42 | Factor:NJ3 |
| F43 | Factor:patient12_1 12/5/02 |
| F44 | Factor:patient12_2 1/16/03 |
| F45 | Factor:patient12_3 5/23/03 |
| F46 | Factor:patient13_1 12/29/11 |
| F47 | Factor:patient13_2 4/28/14 |
| F48 | Factor:patient13_3 7/16/14 |
| F49 | Factor:patient2_1 6/10/07 |
| F50 | Factor:patient2_2 6/11/07 |
| F51 | Factor:patient2_3 4/22/08 |
| F52 | Factor:patient4_1 8/31/10 |
| F53 | Factor:patient4_2 6/11/11 |
| F54 | Factor:patient4_3 7/9/11 |