Clustering data with hclust algorithm for (Study ST003890)
HILIC POSITIVE ION MODE (Analysis AN006390)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 |
|---|---|---|---|---|---|---|---|---|---|
| Deoxycytidine_C12 PARENT | ME1028840 | 0.84 | 1.40 | 0.91 | 0.60 | 0.76 | 0.55 | 0.89 | 1.93 |
| 3-Aminoisobutyrate_C12 PARENT | ME1028715 | 1.24 | 0.84 | 0.66 | 0.65 | 0.74 | 1.33 | 1.31 | 1.14 |
| GMP_C13-label-5 | ME1028906 | 1.23 | 1.06 | NA | 0.66 | NA | NA | NA | 1.17 |
| Glutathione_C13-label-5 | ME1028886 | 0.60 | 1.29 | 1.11 | 0.58 | 0.88 | 0.56 | 1.19 | 1.67 |
| Glycine_C13-label-1 | ME1028899 | 0.83 | 0.76 | 0.90 | 0.86 | 0.84 | 0.97 | 1.37 | 1.42 |
| Glycine_C13-label-2 | ME1028900 | 0.82 | 0.75 | 0.98 | 0.89 | 0.73 | 1.09 | 1.29 | 1.40 |
| Glutathione_C13-label-4 | ME1028885 | 0.65 | 1.07 | 0.69 | 0.99 | 0.81 | 0.96 | 1.64 | 1.14 |
| Glycerophosphocholine_C13-label-2 | ME1028894 | 0.30 | 0.70 | 1.03 | 0.34 | 1.04 | 0.41 | 2.02 | 2.01 |
| Glutathione_C13-label-3 | ME1028884 | 0.76 | 1.37 | 0.74 | 1.08 | 0.97 | 0.80 | 0.88 | 1.31 |
| Glycerophosphocholine_C13-label-3 | ME1028895 | 0.68 | 0.93 | 1.12 | 1.03 | 0.71 | 0.49 | 1.18 | 1.89 |
| Glycerophosphocholine_C13-label-4 | ME1028896 | 0.61 | 0.68 | 0.88 | 1.52 | 1.28 | 0.57 | 1.29 | 1.00 |
| Glycine_C12 PARENT | ME1028898 | 0.98 | 0.81 | 0.93 | 1.39 | 1.02 | 1.01 | 0.97 | 0.98 |
| Glycerol 3-phosphate_C13-label-1 | ME1028889 | 0.88 | 0.89 | 0.95 | 1.15 | 0.77 | 1.26 | 1.20 | 0.89 |
| Glycerophosphocholine_C13-label-1 | ME1028893 | 0.94 | 0.52 | 1.03 | 1.18 | 1.32 | 0.80 | 1.20 | 1.12 |
| Creatinine_C13-label-2 | ME1028825 | 0.62 | 1.19 | 1.29 | 1.13 | 1.25 | 0.62 | 0.79 | 1.04 |
| Creatine phosphate_C13-label-1 | ME1028818 | 1.51 | 1.38 | 0.95 | 0.82 | 1.19 | 0.59 | 0.18 | 1.29 |
| CMP_C13-label-2 | ME1028810 | NA | 0.90 | 0.89 | 1.07 | 0.82 | 0.80 | 1.13 | 1.04 |
| Cystathionine_C12 PARENT | ME1028826 | 0.56 | 0.92 | 0.44 | 1.10 | 2.68 | 0.50 | 0.51 | 1.11 |
| ADP_C12 PARENT | ME1028753 | 1.08 | 1.28 | 0.58 | 1.20 | 0.78 | 1.13 | 1.26 | 0.72 |
| Arginine_C12 PARENT | ME1028777 | 0.70 | 1.03 | 0.80 | 1.01 | 1.30 | 0.80 | 0.76 | 1.50 |
| Creatine phosphate_C13-label-2 | ME1028819 | 1.03 | 1.11 | 0.99 | 1.31 | 0.97 | 1.14 | 0.01 | 0.83 |
| dAMP_C12 PARENT | ME1028832 | 0.44 | 1.41 | 0.79 | 1.49 | 1.14 | 0.67 | 1.09 | 0.98 |
| Coenzyme A_C13-label-3 | ME1028816 | 1.20 | 1.63 | NA | 0.85 | 0.66 | 0.88 | 0.88 | NA |
| Deoxycytidine_C13-label-3 | ME1028842 | 0.60 | 0.49 | 1.01 | 1.94 | 1.79 | 0.76 | 1.00 | 0.15 |
| Creatinine_C12 PARENT | ME1028823 | 0.68 | 0.71 | 1.10 | 1.34 | 0.73 | 0.81 | 0.89 | 1.77 |
| Creatine_C13-label-2 | ME1028822 | 0.76 | 1.17 | 0.97 | 1.00 | 0.98 | 0.70 | 1.05 | 1.35 |
| FAD_C13-label-1 | ME1028846 | 1.08 | 1.16 | 0.57 | 1.66 | 0.84 | 0.77 | 1.26 | 0.82 |
| AMP_C13-label-1 | ME1028768 | 1.00 | 0.96 | 1.09 | 1.13 | 0.96 | 0.81 | 1.22 | 0.94 |
| Adenine_C13-label-1 | ME1028745 | 0.56 | 0.87 | 1.31 | 1.09 | 0.85 | 0.62 | 1.33 | 1.41 |
| AMP_C13-label-3 | ME1028771 | 0.86 | 0.98 | 0.97 | 1.20 | 0.85 | 0.60 | 1.61 | 1.10 |
| Acetyl CoA_C12 PARENT | ME1028730 | 1.28 | 1.29 | 0.45 | 1.86 | 0.58 | 1.37 | 0.71 | 0.60 |
| Asparagine_C12 PARENT | ME1028779 | 0.55 | 1.14 | 0.89 | 1.16 | 1.25 | 0.62 | 1.08 | 1.28 |
| Adenosine_C13-label-4 | ME1028751 | 0.78 | 1.31 | 0.83 | 0.67 | 0.79 | 1.52 | 0.56 | 1.10 |
| ADP_C13-label-2 | ME1028755 | 1.28 | 1.35 | 0.48 | 1.09 | 0.66 | 1.29 | 1.18 | 0.63 |
| ADP_C13-label-3 | ME1028756 | 0.98 | 1.17 | 0.57 | 0.82 | 0.60 | 1.34 | 1.05 | 0.98 |
| Adenosine_C12 PARENT | ME1028747 | 0.94 | 0.90 | 0.71 | 1.11 | 0.73 | 0.86 | 0.90 | 1.84 |
| ADP-ribose_C13-label-3 | ME1028762 | 0.71 | 0.83 | NA | 1.15 | 1.45 | 0.72 | 1.18 | NA |
| ADP-ribose_C12 PARENT | ME1028759 | 1.00 | 0.97 | 0.56 | 1.31 | 1.15 | 1.10 | 1.02 | 0.91 |
| Alanine_C13-label-2 | ME1028765 | 0.35 | 1.24 | 1.19 | 0.67 | 0.40 | 1.36 | 1.98 | 0.65 |
| 5-Deoxy-5-(methylthio)adenosine_C13-label-7 | ME1028729 | 0.66 | 1.29 | 1.31 | 0.99 | 1.02 | 0.94 | 0.67 | 1.07 |
| Adenosine_C13-label-1 | ME1028748 | 0.74 | 1.04 | 0.72 | 1.33 | 1.14 | 0.67 | 0.96 | 1.41 |
| Arginine_C13-label-1 | ME1028778 | 0.93 | 0.89 | 0.77 | 0.76 | 1.59 | 0.64 | 0.76 | 1.56 |
| Coenzyme A_C13-label-2 | ME1028815 | 0.63 | 1.63 | 0.49 | 0.76 | 0.59 | 0.81 | 1.96 | 0.96 |
| AMP_C13-label-2 | ME1028770 | 0.89 | 1.05 | 0.97 | 0.71 | 1.00 | 0.58 | 1.44 | 1.36 |
| Aspartate_C12 PARENT | ME1028781 | 0.79 | 0.89 | 0.66 | 1.35 | 0.82 | 0.63 | 1.30 | 1.64 |
| Cytidine_C12 PARENT | ME1028828 | 0.61 | 0.63 | 0.89 | 1.10 | 1.58 | 0.55 | 0.87 | 1.72 |
| CDP-choline_C13-label-1 | ME1028795 | 0.64 | 0.84 | 0.65 | 1.26 | 1.33 | 0.77 | 1.05 | 1.42 |
| Adenosine_C13-label-3 | ME1028750 | 0.81 | 1.10 | 0.74 | 1.46 | 0.63 | 0.49 | 1.20 | 1.71 |
| Aspartate_C13-label-1 | ME1028782 | 0.56 | 0.86 | 1.37 | 1.11 | 1.06 | 0.64 | 0.92 | 1.48 |
| Carnosine_C13-label-1 | ME1028793 | 1.09 | 0.33 | 0.51 | 1.73 | 1.61 | 0.40 | 1.77 | 1.15 |
| Choline_C13-label-1 | ME1028806 | 0.67 | 1.13 | 0.75 | 1.13 | 1.02 | 1.03 | 1.37 | 0.86 |
| CDP-choline_C12 PARENT | ME1028794 | 0.71 | 0.80 | 0.71 | 0.92 | 1.11 | 0.84 | 1.40 | 1.45 |
| Choline_C12 PARENT | ME1028805 | 0.65 | 0.73 | 0.94 | 1.09 | 1.35 | 0.76 | 1.21 | 1.25 |
| Carnitine_C12 PARENT | ME1028789 | 0.76 | 0.96 | 1.15 | 1.10 | 0.99 | 0.83 | 1.07 | 1.17 |
| Carnitine_C13-label-1 | ME1028790 | 0.85 | 0.55 | 1.09 | 0.50 | 0.54 | 2.80 | 0.53 | 0.65 |
| CDP-choline_C13-label-2 | ME1028796 | 0.66 | 0.87 | 0.73 | 1.23 | 1.03 | 0.67 | 1.29 | 1.53 |
| CDP-ethanolamine_C13-label-3 | ME1028803 | NA | 0.89 | NA | 2.17 | 1.14 | 0.91 | 1.04 | 0.59 |
| Adenosine_C13-label-5 | ME1028752 | NA | 1.35 | 0.10 | 1.10 | 1.00 | 1.08 | NA | NA |
| Deoxycytidine_C13-label-2 | ME1028841 | 0.99 | 0.59 | 0.74 | 1.79 | 2.56 | 0.51 | 0.19 | 0.09 |
| ADP_C13-label-1 | ME1028754 | 1.43 | 1.32 | 0.51 | 1.07 | 0.72 | 1.22 | 1.11 | 0.67 |
| Alanine_C12 PARENT | ME1028763 | 1.96 | 0.27 | 0.52 | 0.40 | 1.98 | 0.67 | 0.44 | 1.76 |
| Adenine_C13-label-2 | ME1028746 | 0.44 | 0.52 | 1.29 | 1.35 | 0.82 | 0.58 | 1.52 | 1.47 |
| Alanine_C13-label-1 | ME1028764 | 0.61 | 0.89 | 1.20 | 1.06 | 0.63 | 1.06 | 1.73 | 0.85 |
| Cytosine_C13-label-1 | ME1028831 | 0.71 | 1.04 | 0.58 | 0.95 | 0.97 | 0.72 | 1.08 | 1.84 |
| Deoxycarnitine_C13-label-1 | ME1028838 | 0.93 | 0.99 | 1.41 | 1.41 | 0.77 | 0.80 | 0.89 | 0.98 |
| Carnitine_C13-label-2 | ME1028791 | 0.67 | 1.01 | 1.29 | 0.98 | 0.69 | 0.95 | 1.10 | 1.28 |
| Choline_C13-label-2 | ME1028807 | 0.97 | 0.64 | 0.75 | 0.92 | 1.41 | 0.76 | 1.13 | 1.41 |
| GDP_C13-label-1 | ME1028851 | 1.83 | 1.17 | 0.52 | 1.02 | 0.65 | 1.12 | 0.98 | 0.76 |
| Coenzyme A_C12 PARENT | ME1028812 | 1.47 | 1.16 | 0.59 | 1.11 | 0.95 | 0.63 | 1.65 | 0.68 |
| ADP-ribose_C13-label-1 | ME1028760 | 0.92 | 1.27 | 0.35 | 0.94 | 1.02 | 1.01 | 1.68 | 0.78 |
| ADP-ribose_C13-label-2 | ME1028761 | 0.88 | 1.28 | 0.59 | 1.26 | 0.70 | 0.90 | 1.36 | 0.94 |
| Asparagine_C13-label-1 | ME1028780 | 0.77 | 1.08 | 0.75 | 1.30 | 1.16 | 0.71 | 1.11 | 1.16 |
| ATP_C12 PARENT | ME1028786 | 1.29 | 1.34 | 0.56 | 1.37 | 0.58 | 1.22 | 0.90 | 0.82 |
| 4-Aminobutyrate (GABA)_C12 PARENT | ME1028721 | 0.82 | 1.06 | 1.36 | 0.85 | 0.86 | 1.32 | 0.82 | 0.78 |
| 3-Methyladenine_C13-label-2 | ME1028719 | 0.46 | 0.68 | 1.26 | 0.74 | 0.49 | 2.13 | 0.21 | NA |
| 3-Methylhistamine_C12 PARENT | ME1028720 | 1.02 | 0.70 | 0.65 | 0.85 | 1.13 | 0.64 | 0.72 | 2.22 |
| 4-Aminobutyrate (GABA)_C13-label-2 | ME1028723 | 0.63 | 1.82 | 1.06 | 0.80 | 0.47 | 1.66 | 1.06 | 0.27 |
| 3-Methyl-2-oxovalerate_C12 PARENT | ME1028716 | 1.16 | 1.13 | 0.71 | 0.98 | 0.88 | 0.90 | 1.03 | 1.23 |
| 4-Aminobutyrate (GABA)_C13-label-1 | ME1028722 | 0.75 | 1.51 | 1.10 | 0.82 | 0.71 | 1.23 | 0.90 | 0.81 |
| Acetyl-arginine_C12 PARENT | ME1028739 | 0.92 | 0.80 | 0.66 | 1.33 | 2.40 | 0.64 | 0.47 | 0.77 |
| Creatine_C13-label-1 | ME1028821 | 1.18 | 1.01 | 0.62 | 1.46 | 0.93 | 0.83 | 0.55 | 1.51 |
| Anserine_C12 PARENT | ME1028774 | 0.77 | 0.82 | 0.94 | 1.49 | 0.85 | 0.80 | 0.94 | 1.47 |
| Aspartate_C13-label-3 | ME1028784 | 0.34 | 0.83 | 1.10 | 0.94 | 0.87 | 0.86 | 1.57 | 1.41 |
| CDP-choline_C13-label-3 | ME1028797 | 0.61 | 0.78 | 0.62 | 1.00 | 1.26 | 0.65 | 1.37 | 1.52 |
| AMP_C13-label-5 | ME1028773 | 0.45 | 0.86 | 0.60 | 1.38 | 0.90 | 0.70 | 0.91 | 1.50 |
| Aspartate_C13-label-4 | ME1028785 | 0.66 | 0.72 | 0.95 | 1.23 | 0.90 | 1.14 | 0.96 | 1.37 |
| CDP-ethanolamine_C12 PARENT | ME1028800 | 0.67 | 0.82 | 0.76 | 1.44 | 1.15 | 0.60 | 0.99 | 1.62 |
| FAD_C12 PARENT | ME1028845 | 0.94 | 1.05 | 0.72 | 1.44 | 0.86 | 0.65 | 1.61 | 0.94 |
| Creatine_C12 PARENT | ME1028820 | 0.88 | 1.03 | 1.07 | 1.06 | 0.94 | 1.02 | 0.69 | 1.25 |
| Creatine phosphate_C12 PARENT | ME1028817 | 1.60 | 1.24 | 1.00 | 1.37 | 1.26 | 0.42 | 0.28 | 1.09 |
| Creatinine_C13-label-1 | ME1028824 | 0.43 | 0.93 | 0.99 | 1.33 | 0.89 | 0.68 | 1.01 | 1.71 |
| Dimethyl-arginine_C13-label-1 | ME1028844 | 0.85 | 1.05 | 1.06 | 1.04 | 0.82 | 0.82 | 0.94 | 1.41 |
| GDP_C12 PARENT | ME1028850 | 1.51 | 1.01 | 0.51 | 1.11 | 0.82 | 1.13 | 1.13 | 0.89 |
| FAD_C13-label-2 | ME1028847 | 0.76 | 0.77 | NA | 0.93 | 0.78 | 1.13 | 1.69 | 0.11 |
| Cytidine_C13-label-1 | ME1028829 | 0.85 | 0.54 | 0.64 | 0.58 | 2.10 | 0.61 | 0.75 | 1.61 |
| AMP_C13-label-10 | ME1028769 | NA | NA | 0.94 | 0.85 | NA | NA | 1.19 | 1.09 |
| Carnosine_C12 PARENT | ME1028792 | 0.59 | 0.74 | 0.94 | 1.53 | 0.92 | 0.65 | 0.83 | 1.85 |
| Acetyl CoA_C13-label-2 | ME1028736 | 2.00 | 1.05 | 0.47 | 1.77 | 0.28 | 0.71 | 0.91 | 0.51 |
| ATP_C13-label-2 | ME1028788 | 1.91 | 1.23 | 0.41 | 0.52 | 0.70 | 0.88 | 1.09 | 0.81 |
| CDP-ethanolamine_C13-label-2 | ME1028802 | 0.94 | 0.85 | 0.82 | 1.22 | 1.02 | 0.66 | 1.30 | 1.30 |
| AMP_C13-label-4 | ME1028772 | 0.82 | 1.03 | 0.63 | 0.96 | 1.20 | 0.44 | 1.49 | 1.49 |
| Adenosine_C13-label-2 | ME1028749 | 0.77 | 0.93 | 0.78 | 1.05 | 1.08 | 0.65 | 1.06 | 1.66 |
| ATP_C13-label-1 | ME1028787 | 1.57 | 1.28 | 0.56 | 0.99 | 0.43 | 1.26 | 1.04 | 0.87 |
| CDP-ethanolamine_C13-label-1 | ME1028801 | 0.72 | 0.71 | 0.80 | 1.29 | 1.01 | 0.55 | 1.32 | 1.68 |
| GDP_C13-label-2 | ME1028853 | 0.15 | 1.42 | 1.30 | 1.33 | 0.13 | 0.94 | 1.27 | 1.34 |
| Deoxycarnitine_C13-label-2 | ME1028839 | 0.74 | 0.69 | 1.16 | 1.39 | 0.98 | 0.82 | 1.00 | 1.31 |
| Dimethyl-arginine_C12 PARENT | ME1028843 | 0.91 | 0.96 | 1.21 | 1.39 | 0.83 | 0.48 | 1.23 | 1.21 |
| Aconitate_C12 PARENT | ME1028742 | 1.07 | 0.71 | 0.84 | 1.30 | 0.99 | 0.94 | 0.99 | 1.25 |
| Aconitate_C13-label-1 | ME1028743 | 0.10 | 1.23 | 0.96 | 0.97 | 1.11 | 1.11 | 1.00 | 1.34 |
| Glycerol 3-phosphate_C13-label-2 | ME1028890 | 0.45 | 1.74 | 0.59 | 0.43 | 0.39 | 1.50 | 1.84 | 0.73 |
| Alanine_C13-label-3 | ME1028766 | 0.64 | 1.13 | 1.10 | 0.94 | 0.80 | 0.98 | 1.19 | 1.14 |
| Aspartate_C13-label-2 | ME1028783 | 0.44 | 1.00 | 1.29 | 0.88 | 0.59 | 0.73 | 1.89 | 1.18 |
| Glutathione_C12 PARENT | ME1028881 | 0.49 | 0.51 | 0.42 | 0.62 | 0.91 | 3.13 | 0.45 | 0.75 |
| GMP_C13-label-2 | ME1028903 | 0.75 | 0.97 | 0.77 | 1.37 | 0.90 | 0.68 | 1.23 | 1.41 |
| AMP_C12 PARENT | ME1028767 | 2.14 | 0.83 | 0.86 | 0.98 | 0.42 | 2.04 | 0.53 | 0.28 |
| Cytosine_C12 PARENT | ME1028830 | 0.80 | 1.31 | 0.70 | 1.21 | 0.89 | 0.75 | 0.62 | 1.67 |
| GTP_C12 PARENT | ME1028908 | 2.14 | 1.32 | 0.55 | 1.04 | 0.71 | 0.98 | 0.84 | 0.60 |
| CMP_C12 PARENT | ME1028808 | 0.84 | 0.79 | 0.73 | 1.50 | 1.22 | 0.66 | 1.10 | 1.28 |
| Anserine_C13-label-1 | ME1028775 | 0.61 | 1.05 | 1.03 | 1.62 | 0.78 | 0.56 | 1.10 | 1.40 |
| GMP_C13-label-4 | ME1028905 | 0.85 | 1.14 | 1.14 | 1.02 | 0.75 | 0.60 | 1.05 | 1.12 |
| 3-Methyladenine_C12 PARENT | ME1028718 | 0.80 | 0.81 | 0.91 | 0.81 | 0.53 | 1.36 | 1.18 | 1.46 |
| Adenine_C12 PARENT | ME1028744 | 0.53 | 0.81 | 0.69 | 1.55 | 1.25 | 0.65 | 1.03 | 1.51 |
| Acetyl-arginine_C13-label-1 | ME1028740 | 1.18 | 0.74 | 0.46 | 0.94 | 3.64 | 0.30 | 0.43 | 0.45 |
| GMP_C13-label-3 | ME1028904 | 0.69 | 0.95 | 0.78 | 1.47 | 0.83 | 0.57 | 1.37 | 1.35 |
| 3-Methyl-2-oxovalerate_C13-label-3 | ME1028717 | 0.58 | 0.54 | 1.02 | 1.26 | 0.96 | 1.03 | 1.31 | 1.29 |
| GMP_C12 PARENT | ME1028901 | 0.78 | 0.86 | 0.85 | 1.20 | 1.30 | 0.75 | 0.96 | 1.32 |
| GMP_C13-label-1 | ME1028902 | 0.94 | 0.88 | 0.78 | 1.16 | 1.08 | 0.74 | 1.18 | 1.31 |
| Acetyl CoA_C13-label-1 | ME1028731 | 2.09 | 1.35 | 0.42 | 1.65 | 0.46 | 1.17 | 0.70 | 0.50 |
| CMP_C13-label-1 | ME1028809 | 0.80 | 0.56 | 0.84 | 1.62 | 1.08 | 0.70 | 1.18 | 1.35 |
| Glucose 6-phosphate_C12 PARENT | ME1028858 | 1.18 | 1.39 | 0.39 | 1.30 | 0.27 | 2.48 | 0.36 | 0.38 |
| Glucosamine_C12 PARENT | ME1028854 | 0.97 | 1.33 | 0.49 | 1.47 | 0.39 | 2.40 | 0.35 | 0.36 |
| Glutamate_C13-label-2 | ME1028864 | 0.17 | 0.87 | 1.15 | 0.68 | 0.84 | 0.92 | 2.10 | 1.15 |
| Glycerophosphocholine_C12 PARENT | ME1028892 | 2.56 | 0.89 | 0.29 | 0.35 | 0.69 | 2.15 | 0.60 | 0.41 |
| 4-Guanidinobutyrate_C12 PARENT | ME1028724 | 0.35 | 0.43 | 1.39 | 0.87 | 0.36 | 0.75 | 2.31 | 1.61 |
| 4-Guanidinobutyrate_C13-label-1 | ME1028725 | 0.17 | 0.22 | 1.07 | 0.53 | 0.98 | 0.89 | 1.68 | 2.23 |
| Glucosamine_C13-label-6 | ME1028857 | 1.32 | 1.00 | 0.57 | 1.07 | 1.17 | 1.18 | 0.52 | 1.05 |
| 5-Deoxy-5-(methylthio)adenosine_C13-label-5 | ME1028728 | 0.22 | 0.36 | 1.37 | 1.71 | 1.07 | 0.99 | 1.52 | 1.07 |
| GTP_C13-label-1 | ME1028909 | 0.82 | 1.14 | NA | 0.95 | NA | 1.08 | 1.39 | NA |
| Guanine_C13-label-5 | ME1028919 | 0.98 | 0.90 | 0.73 | 1.33 | 0.55 | 0.96 | 1.11 | 1.45 |
| Guanidinosuccinic acid_C13-label-2 | ME1028915 | 0.40 | 1.87 | 2.59 | 0.74 | 0.41 | 0.60 | 0.52 | 0.53 |
| Hypotaurine_C12 PARENT | ME1028926 | 0.91 | 0.62 | 0.66 | 1.15 | 0.98 | 1.17 | 1.36 | 1.15 |
| Hypoxanthine_C12 PARENT | ME1028929 | 1.07 | 1.26 | 0.67 | 1.64 | 1.22 | 1.09 | 0.80 | 0.36 |
| Hypoxanthine_C13-label-2 | ME1028931 | 0.69 | 0.95 | 0.77 | 0.69 | 1.15 | 0.83 | 1.46 | 1.35 |
| Guanidinosuccinic acid_C12 PARENT | ME1028913 | 1.14 | 2.01 | 2.28 | 2.83 | 0.09 | 0.15 | 0.22 | 0.04 |
| Homoarginine_C12 PARENT | ME1028924 | 0.59 | 0.48 | 0.45 | 0.28 | 1.17 | 0.68 | 1.15 | 2.86 |
| 2 4-Dihydroxyacetophenone_C12 PARENT | ME1028706 | 0.76 | 1.12 | 0.93 | 1.05 | 1.00 | 0.79 | 1.06 | 1.26 |
| 2-Aminoadipic acid_C13-label-1 | ME1028708 | 0.50 | 0.47 | 0.60 | 0.59 | 2.37 | 0.52 | 0.95 | 1.74 |
| 2-Aminoadipic acid_C13-label-2 | ME1028709 | 0.51 | 0.66 | 0.47 | 0.51 | 2.86 | 0.67 | 0.78 | 1.08 |
| 2-Aminoisobutyrate_C12 PARENT | ME1028710 | 1.11 | 1.09 | 0.95 | 1.25 | 0.40 | 1.02 | 0.81 | 1.43 |
| Homoarginine_C13-label-1 | ME1028925 | 0.67 | 0.41 | 0.48 | 0.75 | 1.28 | 0.56 | 0.77 | 2.72 |
| Hypoxanthine_C13-label-1 | ME1028930 | 0.73 | 1.04 | 1.07 | 0.95 | 1.15 | 0.76 | 1.03 | 1.23 |
| Guanidineacetic acid_C12 PARENT | ME1028910 | 0.68 | 0.87 | 1.18 | 0.93 | 1.04 | 0.91 | 1.00 | 1.32 |
| Guanosine_C13-label-1 | ME1028921 | 0.52 | 0.81 | 1.23 | 0.76 | 1.08 | 0.76 | 0.35 | 1.64 |
| Guanidinosuccinic acid_C13-label-1 | ME1028914 | 0.67 | 1.81 | 2.19 | 1.19 | 0.55 | 0.27 | 0.21 | 0.09 |
| Guanine_C13-label-1 | ME1028918 | 0.76 | 0.76 | 0.84 | 1.36 | 0.98 | 0.75 | 1.03 | 1.58 |
| IMP_C12 PARENT | ME1028932 | 1.18 | 1.35 | 0.47 | 0.88 | 0.60 | 1.49 | 1.03 | 0.87 |
| Guanosine_C12 PARENT | ME1028920 | 0.91 | 0.70 | 0.65 | 1.18 | 1.35 | 0.66 | 0.66 | 1.87 |
| Histamine_C13-label-1 | ME1028923 | 1.11 | 0.73 | 0.64 | 1.06 | 0.87 | 1.00 | 1.26 | 1.37 |
| Hypotaurine_C13-label-1 | ME1028927 | 0.64 | 0.41 | 0.48 | 0.62 | 3.05 | 0.69 | 0.89 | 0.96 |
| Glucose 6-phosphate_C13-label-3 | ME1028861 | 0.68 | 1.23 | NA | 0.53 | NA | 1.59 | 0.43 | 0.54 |
| Glutaryl-Carnitine_C13-label-1 | ME1028873 | 0.40 | 0.39 | 1.51 | 1.00 | 1.06 | 0.65 | 1.16 | 1.80 |
| Glutamate_C12 PARENT | ME1028862 | 0.40 | 0.62 | 1.19 | 0.76 | 0.87 | 1.39 | 1.35 | 1.21 |
| Glutaryl-Carnitine_C13-label-2 | ME1028874 | 0.45 | 0.42 | 1.30 | 0.91 | 0.82 | 0.50 | 0.96 | 2.56 |
| Glutaryl-Carnitine_C13-label-3 | ME1028875 | 0.32 | NA | 0.83 | 0.55 | 1.05 | 0.72 | 0.96 | 2.06 |
| Glutamine_C13-label-2 | ME1028869 | 0.81 | 1.21 | 1.37 | 0.47 | 0.62 | 1.15 | 1.66 | 0.64 |
| Glutaryl-Carnitine_C12 PARENT | ME1028872 | 0.58 | 1.23 | 0.55 | 0.35 | 0.81 | 1.02 | 1.74 | 1.45 |
| Glucosamine_C13-label-2 | ME1028856 | 0.72 | 1.11 | 0.48 | NA | 0.69 | 1.29 | 1.10 | 0.53 |
| 5-Deoxy-5-(methylthio)adenosine_C12 PARENT | ME1028726 | 0.17 | 0.46 | 0.89 | 0.74 | 0.90 | 0.84 | 1.42 | 2.34 |
| Glutathione Disulfide_C13-label-1 | ME1028878 | 0.80 | 1.06 | 1.03 | 1.41 | 0.99 | 0.72 | 0.73 | 1.33 |
| Glutathione_C13-label-2 | ME1028883 | 0.72 | 0.81 | 0.63 | 1.05 | 1.13 | 1.02 | 1.40 | 1.18 |
| Glycerol 3-phosphate_C12 PARENT | ME1028888 | 0.82 | 1.00 | 0.83 | 0.88 | 0.66 | 1.09 | 1.55 | 1.13 |
| 2-Hydroxypyridine_C12 PARENT | ME1028713 | 0.76 | 1.30 | 0.74 | 0.94 | 1.02 | 0.98 | 1.13 | 1.03 |
| 2-methylcitrate_C12 PARENT | ME1028714 | 0.58 | 0.97 | 0.77 | 0.96 | 1.58 | 0.97 | 0.82 | 1.14 |
| 2-Aminoisobutyrate_C13-label-1 | ME1028711 | 1.13 | 1.08 | 0.44 | 1.21 | 1.22 | 0.90 | 0.81 | 1.23 |
| 2-Deoxy-D-glucose_C12 PARENT | ME1028712 | 0.92 | 1.05 | 0.75 | 0.88 | 0.88 | 0.80 | 1.03 | 1.59 |
| Guanidinosuccinic acid_C13-label-3 | ME1028916 | 0.03 | 1.06 | 1.54 | 0.40 | NA | 0.89 | 0.30 | NA |
| Glutathione_C13-label-1 | ME1028882 | 1.25 | 0.88 | 1.18 | 1.04 | 0.64 | 0.50 | 1.00 | 1.69 |
| Histamine_C12 PARENT | ME1028922 | 1.17 | 0.82 | 1.11 | 0.90 | 0.85 | 0.53 | 1.17 | 1.58 |
| Guanidineacetic acid_C13-label-1 | ME1028911 | 0.57 | 0.74 | 1.11 | 0.94 | 0.98 | 0.72 | 1.20 | 1.69 |
| Guanidineacetic acid_C13-label-2 | ME1028912 | 0.59 | 0.73 | 0.78 | 0.76 | 0.96 | 0.80 | 1.76 | 1.44 |
| Guanine_C12 PARENT | ME1028917 | 0.89 | 0.84 | 0.72 | 1.45 | 0.82 | 0.66 | 1.08 | 1.66 |
| Glycerol 3-phosphate_C13-label-3 | ME1028891 | 1.00 | 1.22 | 0.53 | 0.95 | 0.68 | 0.99 | 1.12 | 1.45 |
| Glutathione Disulfide_C13-label-2 | ME1028880 | 0.30 | 1.02 | 1.13 | 1.34 | 0.93 | 0.90 | 0.98 | 1.34 |
| Glyceraldehyde-3-phosphate_C12 PARENT | ME1028887 | 0.72 | 1.07 | 1.09 | 1.25 | 0.38 | 1.07 | 1.20 | 1.25 |
| Glucosamine_C13-label-1 | ME1028855 | 0.77 | 1.13 | 0.40 | 1.13 | 0.24 | 1.87 | 0.79 | 0.30 |
| 2-Aminoadipic acid_C12 PARENT | ME1028707 | 0.82 | 1.08 | 1.30 | 0.99 | 0.93 | 0.73 | 1.65 | 0.62 |
| Glutamine_C12 PARENT | ME1028867 | 0.82 | 0.95 | 0.88 | 1.34 | 0.96 | 0.84 | 1.10 | 1.17 |
| Glutamine_C13-label-1 | ME1028868 | 0.65 | 0.85 | 1.51 | 0.46 | 1.02 | 1.43 | 0.58 | 1.20 |
| Glutamate_C13-label-1 | ME1028863 | 0.52 | 0.36 | 0.99 | 1.09 | 1.25 | 1.17 | 1.13 | 1.37 |
| Glutathione Disulfide_C12 PARENT | ME1028877 | 0.83 | 0.88 | 1.03 | 1.53 | 0.74 | 0.69 | 0.46 | 1.93 |
| Glutamate_C13-label-3 | ME1028865 | 0.34 | 0.80 | 1.33 | 0.65 | 0.75 | 1.01 | 1.95 | 1.07 |
| 1-Methyladenosine_C13-label-2 | ME1028703 | 0.90 | 1.96 | 1.93 | 0.42 | 0.71 | 1.75 | 0.12 | 0.06 |
| 1-Methyladenosine_C12 PARENT | ME1028701 | 0.27 | 0.29 | 1.26 | 0.73 | 0.66 | 0.32 | 1.49 | 1.98 |
| Glucose 6-phosphate_C13-label-2 | ME1028860 | 0.76 | 0.90 | 0.47 | 1.41 | 0.27 | 1.95 | 0.44 | 0.27 |
| Glutamate_C13-label-4 | ME1028866 | 0.40 | 0.67 | 1.41 | 0.96 | 0.71 | 0.68 | 2.09 | 1.15 |
| 5-Deoxy-5-(methylthio)adenosine_C13-label-1 | ME1028727 | NA | 0.61 | 0.59 | 0.66 | 0.32 | 0.54 | 1.50 | 2.45 |
| 1-Methyladenosine_C13-label-3 | ME1028704 | 0.97 | 1.74 | 1.49 | 0.67 | 0.48 | 1.84 | 0.35 | 0.22 |
| 1-Methyladenosine_C13-label-6 | ME1028705 | 0.83 | 1.28 | 1.68 | 0.45 | 0.51 | 1.57 | 0.33 | 0.44 |
| Glutamine_C13-label-4 | ME1028871 | 0.75 | 0.94 | 1.03 | 1.28 | 0.62 | 0.88 | 1.23 | 1.34 |
| Glucose 6-phosphate_C13-label-1 | ME1028859 | 1.10 | 1.55 | 0.54 | 0.90 | 0.26 | 2.24 | 0.46 | 0.41 |
| Glutamine_C13-label-3 | ME1028870 | 0.61 | 1.33 | 0.91 | 0.91 | 0.69 | 1.07 | 1.25 | 1.11 |
| dAMP_C13-label-7 | ME1028835 | 0.61 | 1.02 | 0.88 | 1.20 | 1.30 | 0.83 | 0.97 | 1.15 |
| dAMP_C13-label-8 | ME1028836 | 0.73 | 1.02 | 0.87 | 1.01 | 1.13 | 0.92 | 1.18 | 1.09 |
| Coenzyme A_C13-label-1 | ME1028813 | 1.55 | 1.25 | 0.34 | 1.09 | 0.70 | 0.86 | 1.53 | 0.76 |
| Cystathionine_C13-label-1 | ME1028827 | 0.80 | 1.05 | 0.41 | 0.87 | 2.45 | 0.68 | 0.76 | 0.66 |
| Deoxycarnitine_C12 PARENT | ME1028837 | 1.09 | 0.64 | 1.00 | 1.07 | 1.36 | 1.12 | 0.84 | 0.89 |
Factors:
| F1 | Diet:Control | | Genotype:KP |
| F2 | Diet:Control | | Genotype:PGKP |
| F3 | Diet:Control | | Genotype:PolG |
| F4 | Diet:Control | | Genotype:wt |
| F5 | Diet:Ser/Gly free | | Genotype:KP |
| F6 | Diet:Ser/Gly free | | Genotype:PGKP |
| F7 | Diet:Ser/Gly free | | Genotype:PolG |
| F8 | Diet:Ser/Gly free | | Genotype:wt |