Clustering data with hclust algorithm for (Study ST001167)
(Analysis AN001929)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Cys_M+0 | ME278148 | NA | NA | 0.09 | 0.25 | 0.06 | 0.13 | 0.75 | 0.11 | 1.13 | 1.70 | 4.56 | 0.07 |
| Glutathione (GSSG)_divalent_M+2 | ME278176 | 0.04 | 0.12 | 0.91 | 0.95 | 0.09 | 0.70 | 0.46 | 0.73 | 1.28 | 3.25 | 0.07 | 2.94 |
| Glutathione (GSSG)_divalent_M+3 | ME278177 | 0.06 | 0.08 | 0.67 | 0.69 | 0.06 | 0.67 | 0.46 | 0.60 | 1.16 | 3.11 | 0.07 | 2.61 |
| Gly_M+2 | ME277895 | 0.14 | 0.16 | 0.57 | 0.89 | 0.26 | 1.14 | 0.23 | 0.16 | 1.30 | 4.85 | 0.73 | 1.17 |
| Ser_M+3 | ME278025 | 0.10 | 0.04 | 0.71 | 1.04 | 0.31 | 0.43 | 0.46 | NA | 1.81 | 3.11 | 1.28 | 0.60 |
| Pro_M+4 | ME278087 | NA | NA | 0.69 | 1.09 | NA | 1.58 | 0.85 | 0.69 | 2.44 | 0.62 | 0.78 | 0.29 |
| Ala_M+2 | ME277963 | 0.15 | 0.14 | 1.40 | 3.61 | 0.51 | 0.82 | 0.17 | 0.12 | 0.78 | 2.75 | 0.47 | 0.52 |
| Ala_M+3 | ME277964 | 0.10 | NA | 1.42 | 3.83 | 0.47 | 0.78 | 0.10 | NA | 0.53 | 1.77 | 0.34 | 0.31 |
| Asp_M+2 | ME278164 | 0.07 | 0.07 | 1.67 | 1.82 | 0.57 | 0.96 | 0.22 | 0.19 | 1.43 | 2.29 | 1.12 | 1.26 |
| Glu_M+2 | ME278102 | 0.11 | 0.07 | 1.86 | 2.34 | 0.53 | 1.20 | 0.11 | 0.09 | 1.05 | 2.40 | 0.56 | 1.34 |
| Glu_M+3 | ME278103 | 0.04 | 0.02 | 1.79 | 2.39 | 0.30 | 2.14 | 0.05 | 0.03 | 0.70 | 2.50 | 0.29 | 1.34 |
| Pro_M+2 | ME278085 | 0.12 | 0.15 | 2.03 | 3.22 | 0.40 | 2.18 | 0.08 | 0.11 | 0.47 | 1.79 | 0.29 | 0.80 |
| Gln_M+5 | ME278082 | 0.64 | 0.71 | 1.01 | 0.98 | 0.68 | 1.92 | NA | NA | NA | 1.02 | 0.72 | NA |
| Glu_M+5 | ME278105 | NA | NA | 1.01 | 1.39 | 0.12 | 2.73 | NA | NA | 0.28 | 1.33 | 0.11 | 0.81 |
| Pro_M+3 | ME278086 | 0.21 | 0.15 | 1.15 | 1.68 | 0.32 | 2.09 | NA | NA | 0.28 | 1.07 | 0.16 | 0.51 |
| Asp_M+4 | ME278166 | NA | NA | 0.99 | 1.16 | 0.27 | 2.02 | NA | NA | 0.50 | 1.37 | 0.34 | 0.80 |
| Glu_M+4 | ME278104 | NA | NA | 1.22 | 1.67 | 0.14 | 1.90 | NA | NA | 0.34 | 1.55 | 0.11 | 0.85 |
| Betaine_M+0 | ME278142 | NA | 0.31 | 0.51 | 1.42 | 0.43 | 0.71 | 0.47 | 0.64 | 1.08 | 2.01 | 0.81 | 1.75 |
| Glycerophosphocholine_M+3 | ME278229 | NA | NA | 0.61 | 0.96 | 0.14 | 0.46 | NA | NA | 1.08 | 1.87 | 0.41 | 2.25 |
| 5^-Deoxy-5^-methylthioadenosine_M+5 | ME278037 | NA | NA | 0.95 | 0.85 | NA | 0.66 | NA | NA | 1.05 | 1.07 | NA | 1.33 |
| Glutathione (GSSG)_divalent_M+5 | ME278179 | NA | NA | 0.33 | 0.56 | NA | 0.43 | NA | NA | 0.72 | 1.72 | NA | 1.28 |
| Glutathione (GSH)_M+5 | ME278209 | NA | NA | 0.29 | 0.69 | NA | 1.67 | NA | NA | 0.24 | 1.97 | 0.05 | 1.61 |
| Glutathione (GSH)_M+2 | ME278206 | 0.00 | NA | 0.55 | 0.88 | 0.02 | 0.66 | NA | 0.00 | 1.18 | 2.87 | 0.00 | 1.83 |
| Glutathione (GSSG)_divalent_M+4 | ME278178 | NA | NA | 0.42 | 0.51 | NA | 0.66 | 0.26 | 0.27 | 0.78 | 2.39 | NA | 1.97 |
| Glutathione (GSH)_M+3 | ME278207 | NA | NA | 0.49 | 0.83 | 0.04 | 0.94 | NA | NA | 0.69 | 2.35 | 0.02 | 1.66 |
| Glutathione (GSH)_M+4 | ME278208 | NA | NA | 0.36 | 0.71 | 0.03 | 1.11 | NA | NA | 0.25 | 2.23 | NA | 1.59 |
| Asp_M+3 | ME278165 | NA | NA | 1.25 | 1.35 | 0.25 | 1.20 | 0.17 | NA | 0.92 | 1.70 | 0.96 | 1.01 |
| S-Adenosylmethionine_M+6 | ME277802 | NA | NA | 0.55 | 1.06 | NA | 0.92 | NA | NA | 1.24 | 1.37 | 0.83 | 1.13 |
| N8-Acetylspermidine_M+2 | ME277751 | NA | NA | 0.95 | 0.95 | 0.54 | 1.06 | NA | NA | 1.16 | 0.78 | 0.87 | 1.27 |
| S-Adenosylmethionine_M+5 | ME277801 | NA | NA | 0.95 | 1.24 | 0.62 | 1.02 | NA | NA | 1.35 | 0.82 | 1.10 | 0.80 |
| GABA_M+2 | ME277868 | NA | NA | 0.98 | 1.10 | NA | 0.81 | 0.60 | NA | NA | 1.67 | NA | 0.68 |
| Adenosine_M+5 | ME277997 | NA | NA | 0.85 | 1.26 | NA | NA | NA | NA | 0.66 | 1.23 | 0.58 | 0.84 |
| Argininosuccinic acid_M+2 | ME277983 | NA | NA | 1.22 | 1.89 | 0.45 | 0.66 | NA | NA | 0.49 | 1.19 | NA | 0.39 |
| O-Acetylcarnitine_M+2 | ME277967 | NA | NA | 0.97 | 2.01 | 0.39 | 0.47 | NA | NA | 0.79 | 1.60 | 0.52 | 0.62 |
| Cys-Gly_M+0 | ME277975 | 0.53 | NA | 1.24 | NA | NA | 0.70 | 0.86 | 0.38 | 0.75 | 0.74 | 1.81 | 0.64 |
| Spermine_M+0 | ME277725 | 0.57 | 0.55 | 0.66 | 0.86 | 0.63 | 0.72 | 2.24 | 1.10 | 0.47 | 0.63 | 2.40 | NA |
| γ-Glu-Cys_M+0 | ME278195 | NA | NA | NA | NA | NA | NA | 1.80 | 0.67 | 0.57 | 0.49 | 2.19 | 0.28 |
| Cystathionine_M+0 | ME278014 | 0.07 | 0.06 | 0.03 | 0.07 | 0.03 | 0.03 | 1.89 | 2.22 | 1.63 | 3.27 | 1.55 | 0.45 |
| β-Ala_M+0 | ME277836 | 0.01 | 0.04 | 0.05 | 0.10 | 0.03 | 0.10 | 1.56 | 1.86 | 1.41 | 3.01 | 1.34 | 1.02 |
| Glutathione (GSSG)_divalent_M+1 | ME278175 | 0.16 | 0.34 | 0.86 | 0.71 | 0.19 | 0.27 | 1.01 | 1.61 | 1.81 | 2.41 | 0.18 | 2.04 |
| GABA_M+0 | ME277866 | 0.05 | 0.21 | 0.53 | 0.70 | 0.07 | 0.22 | 1.45 | 1.85 | 1.11 | 3.05 | 0.83 | 1.45 |
| GABA_M+1 | ME277867 | NA | 0.23 | 0.53 | 0.66 | NA | 0.24 | 1.13 | 1.47 | 0.89 | 2.27 | 0.72 | 1.14 |
| 4-Guanidinobutyric acid_M+0 | ME277887 | 0.32 | 0.87 | 0.70 | 0.98 | 0.33 | 0.56 | 1.30 | 1.80 | 1.05 | 2.30 | 0.84 | 0.63 |
| 5-Aminovaleric acid_M+0 | ME277877 | 0.46 | 0.42 | 0.77 | 0.98 | 0.27 | 0.66 | 1.22 | 1.07 | 1.50 | 2.10 | 0.82 | 1.11 |
| Creatinine_M+4 | ME277844 | NA | NA | 0.91 | 1.19 | 0.36 | NA | NA | 1.64 | 0.94 | 1.18 | 0.74 | NA |
| β-Leucine_M+0 | ME277940 | NA | NA | 0.59 | NA | NA | 0.69 | 0.95 | 1.14 | 0.96 | 1.70 | 1.06 | 0.78 |
| β-Ala_M+1 | ME277837 | NA | 0.32 | NA | 0.20 | NA | NA | 1.11 | 1.20 | 1.05 | 1.64 | 1.00 | 0.79 |
| Cystathionine_M+1 | ME278015 | NA | NA | NA | NA | NA | NA | 0.87 | 1.04 | 0.87 | 2.18 | 0.75 | 0.30 |
| Guanidoacetic acid_M+0 | ME277883 | NA | NA | NA | NA | NA | NA | 1.00 | 1.22 | 0.71 | 1.81 | 0.76 | 0.49 |
| β-Ala_M+2 | ME277838 | NA | NA | NA | NA | NA | NA | 0.81 | 0.99 | 0.88 | 1.74 | 0.78 | 0.71 |
| Choline_M+2 | ME277780 | NA | NA | NA | 0.86 | NA | NA | 0.84 | 0.80 | 0.98 | 1.06 | 1.09 | NA |
| Hypotaurine_M+0 | ME278215 | NA | NA | NA | NA | NA | NA | 1.22 | 1.32 | 0.98 | 1.03 | 1.22 | 0.25 |
| Glutathione (GSSG)_divalent_M+0 | ME278174 | 0.35 | 0.69 | 0.73 | 0.49 | 0.30 | 0.11 | 1.74 | 2.69 | 1.78 | 1.33 | 0.30 | 1.14 |
| S-Adenosylhomocysteine_M+0 | ME277925 | 0.47 | 0.69 | NA | NA | 0.49 | NA | 1.50 | 1.83 | 0.84 | 0.47 | NA | NA |
| Citrulline_M+5 | ME278130 | 0.73 | NA | 1.39 | NA | 1.18 | 0.59 | 1.65 | NA | 1.29 | NA | 0.74 | 0.98 |
| N-Acetylputrescine_M+1 | ME277902 | NA | NA | 0.67 | 0.50 | 1.12 | NA | NA | NA | 1.48 | NA | 1.06 | 0.68 |
| N-Acetylputrescine_M+2 | ME277903 | 0.12 | NA | 1.39 | 0.93 | 1.03 | 0.69 | NA | NA | 1.88 | 0.35 | 0.94 | 0.84 |
| N-Acetylputrescine_M+0 | ME277901 | 0.45 | 0.86 | 1.13 | 0.64 | 2.11 | 0.57 | 0.45 | 0.32 | 2.38 | 0.17 | 2.28 | 0.78 |
| Putrescine_M+0 | ME277744 | 0.66 | 0.63 | 1.27 | 1.00 | 3.13 | 1.25 | 0.35 | 0.14 | 0.93 | 0.21 | 1.63 | 0.87 |
| Putrescine_M+1 | ME277745 | 0.59 | 0.64 | 0.99 | 0.94 | 1.91 | 0.87 | NA | NA | 0.66 | NA | 1.08 | 0.97 |
| Creatinine_M+2 | ME277842 | 1.01 | NA | 0.85 | 1.17 | 0.91 | NA | NA | 0.76 | NA | 0.96 | NA | NA |
| Lys_M+2 | ME277786 | 0.63 | NA | 1.41 | 1.01 | 1.23 | NA | 0.70 | 0.65 | NA | NA | NA | NA |
| S-Adenosylmethionine_M+0 | ME277796 | 1.52 | 1.34 | 0.39 | 0.22 | 1.10 | NA | 1.60 | 1.14 | 0.65 | 0.17 | 1.81 | NA |
| 5^-Deoxy-5^-methylthioadenosine_M+0 | ME278032 | 1.15 | 1.37 | 0.52 | NA | 0.82 | NA | 1.25 | 1.32 | 0.66 | NA | 0.87 | NA |
| S-Adenosylmethionine_M+1 | ME277797 | 1.18 | 1.01 | 0.39 | NA | 0.77 | NA | 1.14 | 0.87 | 0.56 | NA | 1.39 | NA |
| Adenosine_M+0 | ME277992 | NA | 0.86 | 0.83 | 0.79 | 1.25 | NA | 1.10 | 1.16 | NA | 0.60 | 1.13 | NA |
| 2-Aminoadipic acid_M+6 | ME278112 | 0.75 | 0.92 | 1.46 | 1.05 | 1.38 | 0.63 | 0.81 | NA | 0.58 | NA | 0.99 | NA |
| Glu-Glu_M+9 | ME278098 | 1.02 | 1.10 | 1.01 | 0.85 | 1.16 | 0.50 | 1.35 | 0.99 | 0.75 | NA | 1.09 | NA |
| Ornithine_M+0 | ME277772 | 1.44 | 1.21 | 1.56 | 3.25 | 1.26 | 0.62 | 0.38 | 0.53 | 0.71 | 0.66 | 0.23 | 0.33 |
| Ornithine_M+1 | ME277773 | 1.23 | 1.00 | 1.34 | 2.77 | 1.07 | 0.60 | 0.42 | 0.50 | 0.62 | 0.55 | NA | 0.30 |
| Ser_M+1 | ME278023 | 1.24 | 1.05 | 1.19 | 1.35 | 1.12 | 0.51 | 0.75 | 0.74 | 1.00 | 1.83 | 0.87 | 0.44 |
| Gly-Gly_M+0 | ME277896 | 0.88 | 1.11 | 1.43 | 1.65 | 1.00 | 0.61 | 0.62 | 0.62 | 0.79 | 1.36 | 0.84 | 0.50 |
| Pro_M+0 | ME278083 | 0.94 | 1.03 | 1.44 | 2.12 | 0.99 | 0.73 | 0.73 | 0.81 | 0.74 | 1.33 | 0.75 | 0.36 |
| Pro_M+1 | ME278084 | 0.92 | 1.02 | 1.41 | 2.09 | 0.98 | 0.78 | 0.72 | 0.81 | 0.75 | 1.34 | 0.75 | 0.41 |
| trans-4-Hydroxyproline_M+0 | ME278168 | 0.97 | 1.04 | 1.33 | 1.93 | 0.97 | 0.52 | 0.86 | 1.00 | 0.83 | 1.45 | 0.79 | 0.29 |
| trans-4-Hydroxyproline_M+1 | ME278169 | 0.98 | 1.03 | 1.31 | 1.86 | 0.97 | 0.55 | 0.86 | 1.00 | 0.85 | 1.46 | 0.82 | 0.30 |
| Arg_M+2 | ME277814 | 0.99 | 1.12 | 1.23 | 1.68 | 1.13 | 0.86 | 0.85 | 0.91 | 0.92 | 1.02 | 0.82 | 0.51 |
| Argininosuccinic acid_M+0 | ME277981 | 1.35 | 1.23 | 1.22 | 1.54 | 1.25 | 0.34 | 0.90 | 0.87 | 1.11 | 1.10 | 0.90 | 0.34 |
| Thr_M+0 | ME278072 | 1.44 | 1.24 | 1.48 | 1.88 | 1.26 | 0.52 | 0.75 | 0.73 | 0.78 | 1.09 | 0.76 | 0.25 |
| Thr_M+1 | ME278073 | 1.40 | 1.23 | 1.44 | 1.81 | 1.24 | 0.57 | 0.75 | 0.75 | 0.77 | 1.10 | 0.78 | 0.32 |
| Argininosuccinic acid_M+1 | ME277982 | 1.25 | 1.10 | 1.30 | 1.62 | 0.97 | 0.40 | 0.75 | 0.65 | 1.01 | 1.22 | 0.77 | 0.42 |
| Asn_M+2 | ME278060 | 1.13 | 1.01 | 1.32 | 1.69 | 1.08 | 0.52 | 0.79 | 0.82 | 0.92 | 1.41 | 0.93 | 0.45 |
| Asn_M+0 | ME278058 | 1.21 | 1.12 | 1.35 | 1.72 | 1.14 | 0.52 | 0.83 | 0.84 | 0.91 | 1.29 | 0.87 | 0.29 |
| Asn_M+1 | ME278059 | 1.21 | 1.12 | 1.34 | 1.68 | 1.13 | 0.55 | 0.83 | 0.84 | 0.89 | 1.27 | 0.89 | 0.32 |
| Arg_M+0 | ME277812 | 1.24 | 1.14 | 1.31 | 1.74 | 1.09 | 0.61 | 0.80 | 0.83 | 0.88 | 1.15 | 0.88 | 0.41 |
| Arg_M+1 | ME277813 | 1.20 | 1.12 | 1.30 | 1.69 | 1.12 | 0.62 | 0.81 | 0.85 | 0.91 | 1.12 | 0.90 | 0.44 |
| Tyr_M+1 | ME278153 | 1.53 | 1.35 | 1.47 | 1.65 | 1.29 | 0.43 | 0.47 | 0.45 | 1.01 | 0.89 | 0.67 | 1.00 |
| His_M+2 | ME277831 | 1.35 | 1.26 | 1.49 | 1.80 | 1.14 | 1.07 | 0.47 | 0.58 | 0.64 | 0.69 | 0.57 | 0.43 |
| Gln_M+2 | ME278079 | 1.50 | 1.29 | 1.52 | 1.52 | 1.34 | 0.70 | 0.78 | 0.62 | 0.78 | 0.87 | 0.76 | 0.52 |
| Tyr_M+2 | ME278154 | 1.52 | 1.45 | 1.55 | 1.70 | 1.33 | 0.68 | 0.51 | 0.58 | 0.76 | 0.82 | 0.66 | 0.54 |
| Ser_M+0 | ME278022 | 1.59 | 1.30 | 1.39 | 1.48 | 1.38 | 0.43 | 0.92 | 0.92 | 0.89 | 0.81 | 0.91 | 0.23 |
| Lys_M+0 | ME277784 | 1.56 | 1.24 | 1.26 | 1.69 | 1.19 | 0.68 | 0.86 | 0.85 | 0.84 | 0.78 | 0.86 | 0.38 |
| Lys_M+1 | ME277785 | 1.55 | 1.26 | 1.26 | 1.65 | 1.19 | 0.68 | 0.88 | 0.82 | 0.82 | 0.84 | 0.81 | 0.41 |
| Gln_M+0 | ME278077 | 1.89 | 1.61 | 1.60 | 1.34 | 1.57 | 0.64 | 0.98 | 0.81 | 0.66 | 0.24 | 0.83 | 0.19 |
| Gln_M+1 | ME278078 | 1.98 | 1.62 | 1.63 | 1.34 | 1.58 | 0.62 | 0.95 | 0.78 | 0.64 | 0.26 | 0.80 | 0.20 |
| Gln_M+3 | ME278080 | 1.89 | 1.53 | 1.62 | 2.28 | 1.33 | 0.54 | 0.42 | 0.54 | 0.56 | 0.84 | 0.51 | 0.24 |
| 2-Aminoadipic acid_M+5 | ME278111 | 1.85 | 1.48 | 1.93 | 2.15 | 1.42 | 0.60 | 0.45 | 0.47 | 0.50 | 0.63 | 0.56 | 0.17 |
| Phe_M+2 | ME278134 | 1.62 | 1.44 | 1.59 | 1.93 | 1.41 | 0.54 | 0.49 | 0.51 | 0.52 | 0.68 | 0.53 | NA |
| 2-Aminoadipic acid_M+4 | ME278110 | 1.93 | 1.61 | 1.76 | 1.95 | 1.29 | 0.63 | 0.53 | 0.58 | 0.43 | 0.79 | 0.60 | 0.20 |
| Val_M+0 | ME278026 | 1.91 | 1.58 | 1.74 | 1.96 | 1.58 | 0.62 | 0.50 | 0.52 | 0.51 | 0.67 | 0.54 | 0.24 |
| Val_M+1 | ME278027 | 1.87 | 1.54 | 1.66 | 1.90 | 1.53 | 0.67 | 0.55 | 0.56 | 0.53 | 0.69 | 0.58 | 0.27 |
| His_M+1 | ME277830 | 1.66 | 1.45 | 1.69 | 2.14 | 1.37 | 0.66 | 0.51 | 0.57 | 0.57 | 0.78 | 0.59 | 0.27 |
| His_M+0 | ME277829 | 1.73 | 1.46 | 1.73 | 2.20 | 1.46 | 0.60 | 0.50 | 0.54 | 0.56 | 0.74 | 0.56 | 0.21 |
| Tyr_M+0 | ME278152 | 1.70 | 1.46 | 1.75 | 2.17 | 1.45 | 0.59 | 0.50 | 0.54 | 0.54 | 0.80 | 0.55 | 0.23 |
| Ile_M+1 | ME278045 | 1.72 | 1.46 | 1.65 | 2.09 | 1.45 | 0.60 | 0.54 | 0.56 | 0.54 | 0.83 | 0.59 | 0.26 |
| Ile_M+2 | ME278046 | 1.66 | 1.46 | 1.61 | 2.05 | 1.45 | 0.61 | 0.55 | 0.57 | 0.54 | 0.87 | 0.62 | 0.29 |
| Phe_M+0 | ME278132 | 1.78 | 1.53 | 1.73 | 2.11 | 1.49 | 0.59 | 0.52 | 0.55 | 0.53 | 0.72 | 0.56 | 0.22 |
| Trp_M+0 | ME278113 | 1.77 | 1.51 | 1.74 | 2.02 | 1.51 | 0.62 | 0.50 | 0.53 | 0.54 | 0.73 | 0.58 | 0.26 |
| Trp_M+1 | ME278114 | 1.76 | 1.50 | 1.73 | 2.01 | 1.52 | 0.62 | 0.47 | 0.53 | 0.57 | 0.75 | 0.59 | 0.27 |
| Ile_M+0 | ME278044 | 1.73 | 1.52 | 1.69 | 2.02 | 1.47 | 0.60 | 0.53 | 0.56 | 0.54 | 0.83 | 0.58 | 0.24 |
| Phe_M+1 | ME278133 | 1.72 | 1.49 | 1.66 | 2.03 | 1.49 | 0.62 | 0.54 | 0.57 | 0.58 | 0.75 | 0.59 | 0.26 |
| Val_M+2 | ME278028 | 1.69 | 1.44 | 1.60 | 1.92 | 1.54 | 0.56 | 0.50 | 0.53 | 0.57 | 0.68 | 0.61 | 0.26 |
| Leu_M+2 | ME278053 | 1.76 | 1.47 | 1.59 | 1.96 | 1.49 | 0.62 | 0.60 | 0.60 | 0.55 | 0.79 | 0.63 | 0.25 |
| Leu_M+0 | ME278051 | 1.80 | 1.52 | 1.62 | 1.90 | 1.52 | 0.60 | 0.57 | 0.59 | 0.55 | 0.83 | 0.59 | 0.24 |
| Leu_M+1 | ME278052 | 1.80 | 1.51 | 1.63 | 1.93 | 1.49 | 0.59 | 0.57 | 0.59 | 0.56 | 0.82 | 0.58 | 0.26 |
| Kynurenine_M+0 | ME278003 | 0.83 | 1.03 | 1.12 | 1.53 | 0.95 | 0.64 | NA | NA | NA | 0.66 | NA | NA |
| trans-4-Hydroxyproline_M+2 | ME278170 | 0.76 | 0.88 | 1.09 | 1.52 | 0.87 | 0.49 | NA | NA | NA | 1.29 | NA | NA |
| Gln_M+4 | ME278081 | 1.02 | 0.62 | 0.92 | 2.48 | 1.07 | 1.14 | 0.36 | 0.40 | 0.57 | 1.49 | 0.54 | 0.78 |
| Thr_M+2 | ME278074 | 1.10 | 0.56 | 0.75 | 2.22 | 0.89 | 1.15 | 0.31 | 0.35 | NA | 1.42 | 0.71 | 0.42 |
| Cys-Gly_M+2 | ME277977 | 0.65 | 0.74 | 1.24 | 0.74 | 1.24 | 1.67 | 0.26 | 1.67 | 0.98 | 0.99 | 0.97 | NA |
| N6,N6,N6-Trimethyllysine_M+0 | ME277819 | 0.96 | 0.80 | 1.09 | 1.46 | 0.78 | 2.20 | 0.85 | 0.77 | 0.84 | 0.82 | 0.90 | NA |
| Ser_M+2 | ME278024 | 0.91 | 0.77 | 0.97 | 1.19 | 0.88 | 0.59 | 0.59 | 0.54 | 1.09 | 2.87 | 0.87 | 0.69 |
| Ala_M+0 | ME277961 | 0.42 | 1.77 | 0.87 | 1.79 | 0.55 | 0.15 | 0.63 | 1.49 | 0.99 | 2.05 | 0.78 | 0.25 |
| Ala_M+1 | ME277962 | 0.65 | 0.98 | 0.92 | 1.72 | 0.58 | NA | 0.53 | 0.96 | 0.96 | 2.18 | 0.71 | 0.62 |
| Glycerophosphocholine_M+2 | ME278228 | 0.32 | NA | NA | 0.61 | 0.65 | NA | 0.96 | 0.72 | 2.07 | 0.76 | 1.56 | 0.37 |
| Glycerophosphocholine_M+0 | ME278226 | 0.67 | 0.36 | 0.62 | 0.44 | 0.69 | 0.07 | 1.35 | 1.13 | 2.34 | 0.96 | 2.72 | 0.49 |
| Glycerophosphocholine_M+1 | ME278227 | 0.64 | 0.35 | 0.60 | 0.42 | 0.65 | NA | 1.23 | 1.04 | 2.09 | 0.90 | 2.41 | 0.49 |
| Asp_M+1 | ME278163 | 0.40 | 0.53 | 0.78 | 0.77 | 0.71 | 0.41 | 1.45 | 1.29 | 1.41 | 1.32 | 1.94 | 0.76 |
| Choline_M+0 | ME277778 | 0.70 | 0.59 | 0.66 | 0.72 | 0.70 | 0.62 | 1.25 | 1.06 | 1.46 | 1.49 | 1.62 | 0.97 |
| Choline_M+1 | ME277779 | 0.75 | 0.59 | 0.69 | 0.72 | 0.71 | 0.62 | 1.26 | 1.06 | 1.43 | 1.48 | 1.57 | 0.98 |
| 2-Aminoadipic acid_M+0 | ME278106 | 0.61 | 0.58 | 0.57 | 0.95 | 0.42 | NA | 1.45 | 0.88 | 1.13 | 1.43 | 1.65 | 0.61 |
| Glu-Glu_M+0 | ME278089 | 0.68 | 0.57 | 0.57 | 0.65 | 0.56 | NA | 1.18 | 1.31 | 1.33 | 1.50 | 1.52 | 0.77 |
| Asp_M+0 | ME278162 | 0.41 | 0.59 | 0.64 | 0.62 | 0.73 | 0.21 | 1.80 | 1.59 | 1.41 | 0.93 | 2.29 | 0.57 |
| Glutathione (GSH)_M+0 | ME278204 | 0.38 | 0.42 | 0.45 | 0.56 | 0.46 | 0.23 | 1.65 | 1.10 | 1.46 | 1.55 | 2.50 | 0.97 |
| Glutathione (GSH)_M+1 | ME278205 | 0.38 | 0.41 | 0.47 | 0.59 | 0.47 | 0.27 | 1.56 | 1.04 | 1.41 | 1.64 | 2.44 | 1.03 |
| O-Acetylcarnitine_M+0 | ME277965 | 0.47 | 0.90 | 0.51 | 1.18 | 0.36 | NA | 1.04 | 1.48 | 1.12 | 1.53 | 1.12 | 0.57 |
| Pyridoxamine 5^-phosphate_M+0 | ME278063 | NA | 0.73 | NA | 0.86 | 0.67 | NA | 1.01 | 1.01 | 0.90 | 1.01 | 1.27 | 1.02 |
| Nicotinamide_M+0 | ME277853 | 0.46 | 0.79 | 0.90 | 0.78 | 0.45 | 1.41 | 0.90 | 1.61 | 1.01 | 1.36 | 0.86 | 1.20 |
| Creatine_M+0 | ME277956 | 0.30 | 0.79 | 0.51 | 0.72 | 0.29 | 1.20 | 1.27 | 1.29 | 0.79 | 2.34 | 1.44 | 0.71 |
| Creatine_M+1 | ME277957 | NA | 1.00 | 0.62 | 0.69 | 0.58 | 0.98 | 1.09 | 1.01 | 0.60 | 1.55 | 1.36 | 0.87 |
| N8-Acetylspermidine_M+0 | ME277749 | 0.98 | 0.83 | 0.62 | 0.82 | 1.72 | 1.12 | 0.96 | 0.89 | 1.25 | 0.68 | 0.82 | 1.49 |
| Citrulline_M+0 | ME278125 | 0.86 | 0.91 | 1.40 | 0.99 | 0.72 | NA | 0.86 | 1.32 | 1.30 | 0.96 | 0.74 | 0.88 |
| Adenine_M+0 | ME277860 | 0.81 | 0.84 | 0.73 | 0.90 | 0.82 | NA | 1.06 | 1.55 | 0.82 | 0.92 | 0.72 | NA |
| Thiamine_M+1 | ME277760 | 0.92 | 0.89 | 1.08 | 1.27 | 0.89 | NA | 0.87 | 0.93 | 1.13 | 0.73 | 1.05 | NA |
| 1-Aminocyclopropane-1-carboxylic acid_M+0 | ME277791 | NA | 0.89 | 0.76 | 0.88 | 1.21 | 1.04 | 1.05 | 0.69 | 1.24 | 0.71 | 1.41 | 0.78 |
| Urea_M+0 | ME278224 | 0.86 | 0.83 | 0.82 | 1.21 | 0.85 | 0.89 | 0.93 | 0.98 | 1.17 | 0.81 | 1.78 | 0.78 |
| Phosphorylcholine_M+2 | ME278220 | 0.58 | 1.08 | 1.13 | 1.10 | 0.79 | 1.04 | 1.09 | 0.85 | 1.04 | 0.95 | 1.50 | 0.66 |
| Phosphorylcholine_M+0 | ME278218 | 0.67 | 1.00 | 1.30 | 1.08 | 0.72 | 0.94 | 1.03 | 1.00 | 1.00 | 0.89 | 1.47 | 0.75 |
| Phosphorylcholine_M+1 | ME278219 | 0.72 | 0.90 | 1.32 | 1.13 | 0.67 | 0.94 | 0.99 | 1.03 | 1.03 | 0.93 | 1.43 | 0.79 |
| Spermidine_M+0 | ME277736 | 0.49 | 0.78 | 1.18 | 1.30 | 0.74 | 0.92 | 1.15 | 0.52 | 1.05 | 1.10 | 1.74 | 0.82 |
| Spermidine_M+1 | ME277737 | 0.88 | 0.82 | 1.00 | 1.11 | 0.82 | 0.98 | 0.91 | 0.54 | 1.06 | 1.10 | 1.55 | 0.80 |
| Thiamine_M+0 | ME277759 | 1.19 | 0.89 | 1.22 | 1.54 | 1.15 | 0.42 | 1.07 | 0.88 | 1.14 | 0.86 | 1.28 | 0.45 |
| Adenine_M+2 | ME277862 | 0.97 | 0.92 | 1.10 | 1.31 | 0.97 | 0.72 | 0.92 | 0.86 | 1.22 | 0.97 | 0.98 | 0.63 |
| Pyridoxine_M+0 | ME277916 | 0.98 | 0.89 | 1.12 | 1.43 | 0.94 | 0.78 | 0.88 | 0.94 | 1.07 | 1.10 | 1.12 | 0.73 |
| 1-Methylnicotinamide_M+1 | ME277846 | 0.89 | 0.89 | 1.12 | 1.47 | 0.94 | 0.67 | 1.01 | 0.96 | 1.19 | 0.99 | 1.18 | 0.65 |
| 1-Methylnicotinamide_M+0 | ME277845 | 0.91 | 0.92 | 1.15 | 1.40 | 0.97 | 0.66 | 1.01 | 0.93 | 1.19 | 1.04 | 1.20 | 0.61 |
| Adenine_M+1 | ME277861 | 0.90 | 0.91 | 1.15 | 1.39 | 0.93 | 0.64 | 1.00 | 0.91 | 1.17 | 1.03 | 1.18 | 0.61 |
| Carnitine_M+0 | ME277908 | 0.91 | 1.00 | 0.80 | 1.18 | 0.62 | 0.50 | 1.30 | 1.50 | 0.97 | 1.17 | 1.21 | 0.72 |
| Glu_M+0 | ME278100 | 0.77 | 0.95 | 0.97 | 1.08 | 0.95 | 0.36 | 1.14 | 1.13 | 1.23 | 1.21 | 1.27 | 0.87 |
| Glu_M+1 | ME278101 | 0.67 | 0.83 | 1.00 | 1.12 | 0.86 | 0.48 | 1.03 | 1.01 | 1.25 | 1.47 | 1.22 | 0.95 |
| DPA | ME278235 | 1.00 | 1.01 | 0.99 | 0.96 | 1.02 | 1.16 | 0.99 | 0.99 | 0.97 | 0.99 | 1.01 | 0.92 |
| 3-AP | ME277724 | 1.04 | 0.99 | 0.97 | 0.91 | 0.97 | 1.40 | 1.00 | 1.01 | 0.97 | 0.85 | 1.02 | 0.88 |
| IS_Methionine sulfone | ME278167 | 1.10 | 1.03 | 1.01 | 0.87 | 1.09 | 1.27 | 1.04 | 0.98 | 0.94 | 0.82 | 1.04 | 0.86 |
| Pyridoxal_M+0 | ME277947 | 0.98 | 0.94 | 0.96 | 1.38 | 0.95 | 1.05 | 0.63 | 0.78 | 0.76 | 1.04 | 0.64 | 1.09 |
| Gly_M+0 | ME277893 | 0.80 | 0.92 | 1.22 | 1.42 | 0.93 | 0.97 | 0.73 | 0.88 | 0.98 | 1.35 | 0.80 | 0.92 |
| Gly_M+1 | ME277894 | 0.81 | 0.91 | 1.19 | 1.37 | 0.96 | 0.95 | 0.77 | 0.88 | 0.96 | 1.41 | 0.79 | 0.94 |
Factors:
| F1 | Cell lines:RWPE1 | Time points:0.25h |
| F2 | Cell lines:RWPE1 | Time points:0h |
| F3 | Cell lines:RWPE1 | Time points:12h |
| F4 | Cell lines:RWPE1 | Time points:24h |
| F5 | Cell lines:RWPE1 | Time points:4h |
| F6 | Cell lines:RWPE1 | Time points:6days |
| F7 | Cell lines:VCaP | Time points:0.25h |
| F8 | Cell lines:VCaP | Time points:0h |
| F9 | Cell lines:VCaP | Time points:12h |
| F10 | Cell lines:VCaP | Time points:24h |
| F11 | Cell lines:VCaP | Time points:4h |
| F12 | Cell lines:VCaP | Time points:6days |
