Clustering data with hclust algorithm for (Study ST001940)
HILIC NEGATIVE ION MODE (Analysis AN003158)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 |
|---|---|---|---|---|---|---|---|---|---|
| cholate | ME448047 | 0.53 | 0.15 | 0.09 | 0.49 | 1.96 | 4.82 | 6.28 | 4.24 |
| 12-dehydrocholate | ME447750 | 0.50 | 0.23 | 0.13 | 0.75 | 4.05 | 2.95 | 5.53 | 0.95 |
| spermidine | ME448519 | 0.75 | 0.46 | 0.65 | 0.49 | 2.92 | 3.19 | 3.15 | 2.53 |
| taurocholate | ME448541 | 0.04 | 0.18 | 3.19 | 0.38 | 0.23 | 2.75 | 5.17 | 0.75 |
| 13-HODE + 9-HODE | ME447751 | 0.40 | 0.81 | 0.99 | 0.85 | 4.36 | 0.40 | 9.67 | 0.51 |
| phenol sulfate | ME448444 | 0.25 | 0.33 | 1.88 | 1.24 | 0.68 | 0.17 | 8.39 | 0.11 |
| 1-stearoyl-GPS (18:0)* | ME447798 | 0.97 | 0.55 | 0.99 | 1.01 | 0.21 | 1.02 | 7.40 | 1.12 |
| 2-oleoylglycerol (18:1) | ME447837 | 1.04 | 0.60 | 0.75 | 0.87 | 0.86 | 0.33 | 8.56 | 0.73 |
| docosahexaenoate (DHA; 22:6n3) | ME448103 | 0.45 | 0.97 | 0.63 | 0.94 | 1.51 | 0.65 | 6.71 | 0.82 |
| norvaline | ME448393 | 0.44 | 1.72 | 0.43 | 0.36 | 1.05 | 0.51 | 6.19 | 0.88 |
| 1-methyladenine | ME447763 | 0.77 | 0.61 | 0.66 | 0.93 | 2.99 | 0.49 | 6.69 | 0.75 |
| 1-oleoylglycerol (18:1) | ME447773 | 0.92 | 0.53 | 0.85 | 0.92 | 2.14 | 0.36 | 7.69 | 0.74 |
| 1,2,3-benzenetriol sulfate (2) | ME447736 | 0.05 | 6.12 | 0.06 | 3.51 | 0.07 | 0.18 | 0.19 | 0.06 |
| 1-linoleoylglycerol (18:2) | ME447760 | 0.79 | 0.57 | 0.89 | 0.91 | 4.37 | 0.27 | 6.50 | 0.37 |
| 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) | ME447786 | 0.86 | 0.60 | 0.79 | 0.59 | 6.74 | 1.58 | 5.11 | 1.18 |
| uridine-2^,3^-cyclic monophosphate | ME448580 | 0.56 | 0.84 | 0.98 | 0.90 | 5.28 | 0.82 | 5.15 | 0.83 |
| 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) | ME447782 | 0.76 | 0.47 | 1.71 | 0.40 | 6.44 | 0.49 | 5.55 | 0.40 |
| 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) | ME447785 | 0.97 | 0.49 | 1.41 | 0.54 | 6.06 | 0.45 | 5.35 | 0.23 |
| gamma-glutamylalanine | ME448142 | 0.48 | 0.54 | 0.62 | 1.01 | 8.05 | 0.68 | 2.98 | 0.86 |
| sarcosine | ME448504 | 0.87 | 0.55 | 0.66 | 0.88 | 8.27 | 0.36 | 4.40 | 0.70 |
| 1-stearoyl-2-linoleoyl-GPC (18:0/18:2)* | ME447792 | 1.18 | 0.58 | 1.05 | 0.72 | 5.65 | 0.49 | 3.61 | 0.24 |
| arginine | ME447992 | 0.87 | 0.29 | 1.80 | 0.66 | 6.48 | 0.52 | 2.57 | 1.04 |
| linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]* | ME448264 | 0.84 | 0.44 | 1.56 | 0.57 | 9.66 | 0.73 | NA | 0.89 |
| agmatine | ME447961 | 0.62 | 0.28 | 0.28 | 1.01 | 7.89 | 0.38 | 1.03 | 1.44 |
| ornithine | ME448419 | 0.70 | 0.68 | 0.95 | 0.80 | 7.70 | 0.70 | 1.26 | 1.05 |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]* | ME448269 | 0.81 | 0.61 | 1.18 | 0.96 | 7.77 | 0.51 | 0.27 | 0.46 |
| 1-stearoyl-GPC (18:0) | ME447794 | 1.15 | 0.40 | 1.39 | 0.73 | 8.01 | 0.40 | 1.42 | 0.44 |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [1] | ME448415 | 0.79 | 0.45 | 1.06 | 1.15 | 8.47 | 0.31 | 0.90 | 0.22 |
| indoleacetylaspartate | ME448226 | 0.18 | 0.19 | 0.12 | 1.91 | 7.01 | 0.38 | 0.11 | 0.40 |
| 1-linoleoyl-GPE (18:2)* | ME447762 | 1.24 | 0.63 | 2.40 | 0.49 | 5.66 | 0.34 | 0.56 | 0.76 |
| choline phosphate | ME448456 | 0.73 | 0.30 | 1.23 | 1.23 | 6.79 | 0.26 | 0.91 | 0.87 |
| oleoyl-oleoyl-glycerol (18:1/18:1) [1]* | ME448417 | 0.73 | 0.38 | 1.04 | 1.62 | 5.89 | 0.31 | 0.89 | 0.12 |
| linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]* | ME448268 | 1.02 | 0.63 | 1.17 | 1.01 | 6.18 | 0.36 | 0.58 | 0.39 |
| oleoyl-linoleoyl-glycerol (18:1/18:2) [2] | ME448416 | 0.85 | 0.57 | 1.22 | 1.11 | 6.17 | 0.49 | 0.65 | 0.33 |
| 2,8-quinolinediol | ME447805 | 0.57 | 1.26 | 1.11 | 0.63 | 3.23 | 0.93 | 0.35 | 1.11 |
| gamma-glutamyltyrosine | ME448153 | 0.67 | 0.89 | 0.94 | 0.94 | 3.33 | 1.00 | 0.65 | 1.97 |
| imidazole lactate | ME448220 | 0.63 | 0.56 | 1.34 | 0.76 | 3.85 | 1.08 | 0.61 | 2.37 |
| guanidinoacetate | ME448191 | 0.89 | 0.25 | 1.48 | 0.93 | 4.37 | 0.19 | 0.77 | 1.97 |
| succinate | ME448531 | 1.57 | 0.57 | 1.04 | 0.75 | 4.57 | 0.27 | 0.50 | 2.62 |
| 1-linoleoyl-GPC (18:2) | ME447761 | 1.61 | 0.50 | 1.89 | 0.43 | 3.95 | 0.30 | 1.06 | 0.94 |
| maltotetraose | ME448285 | 1.03 | 0.74 | 1.99 | 0.38 | 4.07 | 0.52 | NA | 1.29 |
| nervonate (24:1n9)* | ME448369 | 0.64 | 0.85 | 0.46 | 1.69 | 2.76 | 0.21 | 1.20 | 0.05 |
| 1-oleoyl-GPC (18:1) | ME447774 | 1.16 | 0.68 | 1.04 | 0.88 | 5.62 | 0.29 | 2.24 | 0.26 |
| behenate (22:0)* | ME447999 | 0.82 | 0.85 | 0.62 | 1.20 | 5.07 | 0.28 | 1.77 | 0.19 |
| 1-oleoyl-2-linoleoyl-GPC (18:1/18:2)* | ME447772 | 1.84 | 0.61 | 1.20 | 0.56 | 4.70 | 0.47 | 2.38 | 0.25 |
| 1-stearoyl-GPE (18:0) | ME447795 | 1.33 | 0.57 | 1.05 | 0.94 | 4.52 | 0.57 | 1.44 | 0.68 |
| tryptophan betaine | ME448569 | 1.61 | 0.62 | 0.57 | 0.81 | 4.09 | 0.53 | 1.82 | 0.30 |
| 1-oleoyl-GPE (18:1) | ME447775 | 1.40 | 0.62 | 0.98 | 1.01 | 3.48 | 0.68 | 1.36 | 0.63 |
| argininosuccinate | ME447993 | 1.31 | 0.43 | 1.11 | 0.62 | 3.17 | 0.41 | 1.44 | 0.34 |
| 1-(1-enyl-oleoyl)-GPE (P-18:1)* | ME447732 | 1.30 | 0.80 | 0.88 | 0.95 | 3.43 | 0.64 | 0.79 | 0.95 |
| 1-(1-enyl-stearoyl)-GPE (P-18:0)* | ME447734 | 1.21 | 0.52 | 1.17 | 0.88 | 3.82 | 0.81 | 1.22 | 1.39 |
| N-acetylmethionine sulfoxide | ME448345 | 0.90 | 0.81 | 0.76 | 1.06 | 3.49 | 0.78 | 1.59 | 1.09 |
| gamma-glutamylglutamate | ME448145 | 1.09 | 0.75 | 0.84 | 0.91 | 3.59 | 1.27 | 2.91 | 1.29 |
| cytidine 2^,3^-cyclic monophosphate | ME448068 | 0.96 | 0.76 | 0.99 | 0.81 | 3.93 | 0.91 | 2.35 | 1.05 |
| histidine | ME448209 | 0.69 | 0.79 | 1.26 | 0.73 | 3.75 | 1.19 | 1.96 | 1.26 |
| glycerol | ME448169 | 0.90 | 0.68 | 1.15 | 0.87 | 4.28 | 0.36 | 3.29 | 0.67 |
| 1-stearoyl-2-oleoyl-GPC (18:0/18:1) | ME447793 | 1.08 | 0.79 | 0.92 | 0.89 | 4.07 | 0.69 | 2.46 | 0.33 |
| palmitoyl sphingomyelin (d18:1/16:0) | ME448431 | 0.69 | 0.67 | 0.97 | 1.28 | 3.99 | 0.52 | 2.28 | 0.43 |
| phenylacetylglycine | ME448448 | 0.32 | NA | 1.12 | 0.71 | 4.77 | NA | NA | 0.39 |
| oleoyl-oleoyl-glycerol (18:1/18:1) [2]* | ME448418 | 0.84 | 0.50 | 1.13 | 1.42 | 4.65 | 0.50 | 0.77 | 0.21 |
| 4-hydroxycinnamate | ME447902 | 0.39 | 0.73 | 0.92 | 1.77 | 4.05 | 0.44 | 1.47 | 0.53 |
| palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]* | ME448428 | 0.47 | 0.61 | 0.59 | 2.07 | 4.01 | 0.42 | 0.64 | 0.87 |
| pyridoxine (Vitamin B6) | ME448484 | 1.21 | 0.84 | 0.61 | 0.88 | 4.12 | 1.27 | 0.19 | 0.66 |
| theanine | ME448547 | 0.91 | 0.83 | 0.56 | 0.90 | 4.84 | 1.43 | 0.98 | 0.41 |
| lactosyl-N-nervonoyl-sphingosine (d18:1/24:1)* | ME448244 | 0.48 | 1.18 | 0.63 | 0.87 | 4.56 | 0.96 | 0.54 | 0.80 |
| lactosyl-N-palmitoyl-sphingosine (d18:1/16:0) | ME448245 | 0.48 | 1.00 | 0.69 | 0.85 | 5.34 | 1.13 | 0.90 | 1.08 |
| 5-aminovalerate | ME447933 | 0.96 | 0.46 | 0.68 | 0.75 | 4.81 | 1.92 | 0.42 | 2.88 |
| betaine | ME448009 | 0.35 | 0.43 | 2.58 | 0.45 | 4.07 | 0.34 | 0.64 | 3.05 |
| creatine | ME448059 | 0.29 | 0.08 | 2.51 | 0.57 | 4.19 | 0.71 | 2.06 | 3.27 |
| 2,3-dihydroxy-2-methylbutyrate | ME447800 | 0.87 | 0.51 | 0.84 | 0.24 | 0.09 | 1.56 | 2.01 | 4.67 |
| palmitoleate (16:1n7) | ME448426 | 0.52 | 0.82 | 0.57 | 0.91 | 0.34 | 1.16 | 3.05 | 3.64 |
| phenyllactate (PLA) | ME448452 | 0.57 | 0.63 | 0.59 | 0.62 | 0.71 | 1.49 | 4.57 | 3.84 |
| allantoin | ME447964 | 0.14 | 0.42 | 2.78 | 0.32 | 1.07 | 0.41 | 0.85 | 3.71 |
| galactonate | ME448139 | 0.28 | 0.19 | 2.85 | 0.28 | 0.33 | 1.12 | 0.08 | 5.78 |
| ribonate | ME448495 | 0.41 | 0.22 | 2.71 | 0.37 | 0.33 | 0.65 | 0.61 | 5.44 |
| phenethylamine | ME448443 | 0.42 | 1.11 | 0.33 | 0.42 | 0.26 | 1.56 | 0.24 | 6.47 |
| apigenin | ME447983 | 0.86 | 0.17 | 0.16 | 0.24 | 1.02 | 0.58 | 0.29 | 5.81 |
| 1,2-dilinolenoyl-digalactosylglycerol (18:3/18:3) | ME447737 | 1.08 | 0.21 | 0.14 | 0.92 | 0.20 | 0.05 | 0.39 | 5.35 |
| 1,2-dilinolenoyl-galactosylglycerol (18:3/18:3)* | ME447738 | 0.77 | 0.11 | 0.10 | 0.97 | 0.20 | 0.05 | 0.15 | 6.45 |
| hesperetin | ME448199 | 0.64 | 0.10 | 1.08 | 0.15 | 0.23 | 0.63 | 0.09 | 4.89 |
| N-acetylglucosamine 6-sulfate | ME448334 | 0.29 | 0.31 | 1.11 | 1.29 | NA | 0.18 | NA | 5.57 |
| chrysoeriol | ME448051 | 0.13 | 0.07 | NA | 0.42 | 1.42 | NA | 0.14 | 4.56 |
| 1-linoleoyl-2-linolenoyl-galactosylglycerol (18:2/18:3)* | ME447759 | 0.80 | 0.43 | 1.03 | 0.35 | 1.70 | 0.34 | 0.48 | 5.00 |
| naringenin | ME448360 | 0.65 | 0.33 | 1.51 | 0.24 | 1.80 | 0.84 | 0.50 | 5.84 |
| glycocholenate sulfate* | ME448180 | 0.51 | 0.07 | 4.03 | 0.09 | 0.26 | 1.14 | 0.01 | 0.80 |
| acetylcarnitine (C2) | ME447955 | 0.13 | 0.08 | 4.20 | 0.17 | 0.38 | 0.90 | 0.09 | 2.11 |
| arabonate/xylonate | ME447986 | 0.24 | 0.13 | 4.83 | 0.15 | 0.80 | 0.28 | 0.30 | 2.21 |
| laurylcarnitine (C12) | ME448249 | 0.47 | 0.16 | 3.47 | 0.19 | 0.43 | 0.76 | 0.72 | 2.62 |
| pyroglutamine* | ME448485 | 0.59 | 0.28 | 3.77 | 0.33 | 0.42 | 0.30 | 0.71 | 2.45 |
| 5-(2-Hydroxyethyl)-4-methylthiazole | ME447914 | 0.71 | 1.02 | 3.41 | 0.52 | 0.30 | 0.24 | 0.38 | 1.83 |
| gluconate | ME448159 | 0.75 | 0.35 | 3.86 | 0.39 | 0.38 | 0.68 | 0.17 | 1.20 |
| sucrose | ME448535 | 0.46 | 0.44 | 3.85 | 0.47 | 0.20 | 0.47 | 0.14 | 1.74 |
| hesperidin | ME448200 | 0.28 | NA | 1.96 | 0.03 | NA | NA | NA | 1.74 |
| 2,8-quinolinediol sulfate | ME447806 | NA | NA | 2.51 | NA | 0.80 | 0.47 | NA | 0.22 |
| oleoyl-linolenoyl-glycerol (18:1/18:3) [2]* | ME448414 | 0.87 | 0.61 | 2.45 | 1.04 | 0.03 | 0.05 | 0.03 | 0.82 |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]* | ME448266 | 0.82 | 0.61 | 2.68 | 1.06 | 0.60 | 0.11 | 0.05 | 0.28 |
| linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]* | ME448267 | 0.74 | 0.73 | 2.78 | 0.90 | 0.38 | 0.18 | 0.02 | 0.46 |
| palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]* | ME448434 | 0.63 | 0.61 | 2.74 | 0.86 | 0.26 | 0.24 | 0.06 | 0.41 |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [1]* | ME448261 | 1.02 | 0.47 | 3.42 | 0.48 | 0.02 | 0.02 | 0.01 | 0.09 |
| thiamin (Vitamin B1) | ME448550 | 1.20 | 0.88 | 2.92 | 0.44 | 0.06 | 0.15 | 0.07 | 0.52 |
| dopamine 3-O-sulfate | ME448107 | NA | 0.35 | 3.69 | 0.72 | NA | NA | NA | 0.17 |
| 3-(N-acetyl-L-cystein-S-yl) acetaminophen | ME447850 | 0.63 | 0.13 | 3.00 | 0.86 | NA | 0.11 | NA | NA |
| 4-acetaminophen sulfate | ME447895 | 0.11 | 0.02 | 3.16 | 0.51 | NA | NA | NA | NA |
| loperamide | ME448273 | NA | 0.09 | 2.36 | NA | 0.01 | NA | 0.19 | NA |
| ranitidine | ME448491 | 0.21 | 0.64 | 2.99 | 0.12 | NA | 0.00 | NA | 0.01 |
| 2-hydroxyibuprofen | ME447827 | 0.67 | 1.52 | 2.88 | 0.29 | 1.32 | NA | 0.47 | 0.37 |
| tauroursodeoxycholate | ME448545 | 0.81 | 0.51 | 2.91 | 0.25 | 1.09 | 1.73 | 1.13 | 1.08 |
| glucuronate | ME448161 | 0.55 | 0.37 | 3.65 | 0.73 | 1.05 | 0.62 | 0.32 | 0.87 |
| gamma-glutamylisoleucine* | ME448149 | 0.35 | 0.39 | 3.33 | 0.53 | 1.28 | 0.38 | 0.55 | 1.57 |
| taurocholenate sulfate | ME448542 | 0.55 | 0.28 | 2.80 | 0.33 | 1.17 | 0.81 | 0.17 | 1.25 |
| 2-oxoarginine* | ME447841 | 0.40 | 0.65 | 3.25 | 0.54 | 1.25 | 0.61 | 1.12 | 0.35 |
| taurochenodeoxycholate | ME448540 | 0.08 | 0.18 | 2.89 | 0.36 | 1.69 | 0.86 | 0.99 | 1.00 |
| 4-acetamidophenol | ME447893 | 1.30 | 0.32 | 5.71 | 0.74 | 0.02 | 0.25 | NA | 0.14 |
| mannitol/sorbitol | ME448287 | 0.05 | 0.06 | 6.49 | 0.04 | 0.05 | 0.07 | 0.05 | 0.09 |
| glycochenodeoxycholate | ME448178 | 0.04 | 0.08 | 5.80 | 0.18 | 0.58 | 0.13 | 0.14 | 0.14 |
| ferulic acid 4-sulfate | ME448128 | NA | 0.26 | 5.49 | 0.04 | 0.06 | 0.08 | NA | 0.06 |
| glycocholate | ME448179 | 0.02 | 0.05 | 5.72 | 0.10 | 0.01 | 0.05 | 0.01 | 0.05 |
| linolenoyl-linolenoyl-glycerol (18:3/18:3) [2]* | ME448262 | 0.82 | 0.44 | 4.20 | 0.33 | 0.01 | 0.02 | 0.01 | 0.14 |
| glycodeoxycholate | ME448181 | 0.12 | 0.16 | 5.18 | 0.35 | 0.63 | 0.20 | 0.15 | 0.13 |
| glycoursodeoxycholate | ME448186 | 0.05 | 0.24 | 4.85 | 0.27 | 0.23 | 0.25 | 0.11 | 0.18 |
| citrate | ME448056 | 0.36 | 0.17 | 4.45 | 0.27 | 0.08 | 0.51 | 0.08 | 0.31 |
| glycolithocholate sulfate* | ME448182 | 0.45 | 0.15 | 5.08 | 0.12 | 0.05 | 0.25 | 0.05 | 0.31 |
| taurolithocholate 3-sulfate | ME448544 | 0.64 | 0.22 | 4.79 | 0.27 | 0.16 | 0.05 | NA | 0.19 |
| threonate | ME448552 | 0.28 | 0.21 | 4.96 | 0.16 | 0.43 | 0.19 | 0.42 | 1.23 |
| cystine | ME448066 | 0.35 | 0.20 | 5.01 | 0.28 | 0.43 | 0.36 | 1.09 | 0.38 |
| tartarate | ME448538 | 0.71 | 0.32 | 5.42 | 0.48 | 0.22 | 0.56 | 0.44 | 0.70 |
| 4-methylthio-2-oxobutanoate | ME447911 | 0.53 | 0.80 | 4.05 | 1.38 | 0.24 | 0.25 | 1.58 | 0.74 |
| urate | ME448578 | 0.25 | 0.24 | 4.71 | 0.40 | 0.67 | 0.21 | 2.08 | 0.14 |
| N-acetyl-aspartyl-glutamate (NAAG) | ME448329 | 2.12 | 0.14 | 0.12 | 0.13 | NA | 4.68 | 0.09 | 0.31 |
| 7-ketolithocholate | ME447947 | 1.75 | 0.32 | 1.09 | 0.41 | 1.31 | 4.62 | 1.24 | 0.84 |
| isoursodeoxycholate | ME448235 | 0.92 | 0.79 | 0.26 | 0.67 | 1.47 | 4.30 | 2.15 | 1.20 |
| ursodeoxycholate | ME448582 | 0.85 | 0.60 | 0.21 | 0.56 | 1.07 | 4.08 | 2.07 | 2.09 |
| (15:0)-anacardic acid | ME447729 | NA | 0.71 | 1.27 | 0.46 | NA | 2.51 | NA | 0.88 |
| 3-hydroxyoctanoate | ME447870 | 0.53 | 0.54 | 0.44 | 0.46 | 0.41 | 4.12 | 0.76 | 1.17 |
| feruloylputrescine | ME448129 | 0.52 | 0.91 | 0.60 | 0.49 | 1.07 | 4.37 | 0.72 | 1.13 |
| adipate (C6-DC) | ME447960 | 0.65 | 0.98 | 0.47 | 1.20 | 0.03 | 3.37 | 0.34 | 0.61 |
| I-urobilinogen | ME448238 | 0.74 | 0.96 | 0.83 | 0.65 | 0.72 | 3.51 | 0.17 | 1.02 |
| syringic acid | ME448537 | 0.59 | 1.13 | 0.47 | 0.40 | 0.85 | 2.80 | 0.51 | 2.22 |
| 5alpha-androstan-3alpha,17beta-diol monosulfate (1) | ME447920 | 0.60 | 0.64 | 0.46 | 1.03 | 0.37 | 2.69 | 0.39 | 1.53 |
| N-acetyltaurine | ME448354 | 0.98 | 0.88 | 0.71 | 0.88 | 0.09 | 3.24 | 0.93 | 2.01 |
| liquiritigenin | ME448270 | 0.13 | 0.53 | 1.20 | 0.64 | 0.96 | 3.44 | 0.04 | 2.25 |
| succinylcarnitine (C4-DC) | ME448533 | 0.48 | 0.55 | 0.41 | 1.12 | 0.50 | 4.15 | 0.12 | 2.07 |
| piperine | ME448465 | 0.24 | 0.96 | 0.15 | 0.81 | 0.14 | 5.68 | 0.90 | 0.63 |
| carnosine | ME448033 | 0.41 | 0.40 | 0.17 | 0.37 | NA | 4.79 | 1.24 | 3.32 |
| 2-piperidinone | ME447843 | 1.20 | 0.66 | 0.68 | 0.58 | 0.26 | 5.34 | 0.12 | 1.95 |
| 7-ketodeoxycholate | ME447946 | 1.18 | 0.19 | 0.29 | 0.23 | 0.66 | 6.37 | 0.60 | 2.56 |
| acesulfame | ME447954 | 0.21 | 1.91 | 0.14 | 1.42 | 0.15 | 0.06 | 1.48 | 0.07 |
| N-palmitoyltaurine | ME448398 | 0.39 | 1.47 | 0.14 | 1.54 | NA | 0.59 | 2.91 | 0.35 |
| N-stearoyltaurine | ME448403 | 0.43 | 1.68 | 0.27 | 0.98 | NA | 0.48 | 2.50 | NA |
| N-methylhydantoin | ME448384 | 1.23 | 0.71 | 0.45 | 0.83 | 1.33 | 0.24 | 4.49 | 0.88 |
| arachidate (20:0) | ME447987 | 0.87 | 0.93 | 0.95 | 1.11 | 0.94 | 0.27 | 4.70 | 0.20 |
| eicosenoate (20:1) | ME448112 | 0.65 | 0.94 | 1.01 | 0.99 | 1.18 | 0.78 | 4.79 | 0.42 |
| valerylphenylalanine | ME448587 | 0.53 | 0.43 | 0.50 | 0.88 | 0.29 | NA | 4.97 | NA |
| 3-hydroxyvalerate | ME447877 | 0.78 | 0.68 | NA | 0.54 | NA | 0.45 | 4.01 | 0.40 |
| glycosyl-N-stearoyl-sphingosine (d18:1/18:0) | ME448185 | 0.95 | 1.46 | 0.69 | 0.92 | 0.16 | 0.48 | 4.60 | 0.24 |
| N-acetylputrescine | ME448350 | 0.68 | 1.09 | 0.65 | 0.52 | 0.27 | 1.90 | 4.06 | 2.42 |
| heptanoate (7:0) | ME448198 | 1.09 | 0.96 | 0.71 | 1.04 | 0.10 | 0.31 | 3.36 | 2.31 |
| N-(2-hydroxypalmitoyl)-sphingosine (d18:1/16:0(2OH)) | ME448312 | 0.69 | 0.84 | 0.60 | 1.01 | 0.61 | 1.55 | 3.43 | 1.76 |
| 1-palmitoyl-GPI (16:0) | ME447790 | 1.59 | 0.64 | 1.02 | 0.66 | 0.12 | 1.21 | 3.19 | 1.69 |
| N-propionylmethionine | ME448400 | 1.34 | 0.95 | 0.89 | 0.65 | 0.67 | 0.92 | 3.21 | 2.00 |
| methionine sulfone | ME448293 | 0.46 | 1.67 | 0.52 | 0.34 | 0.34 | 0.62 | 3.55 | 1.06 |
| alpha-hydroxyisovalerate | ME447968 | 0.28 | 2.16 | 0.35 | 0.38 | 0.72 | 0.31 | 2.82 | 1.87 |
| N-acetylleucine | ME448343 | 0.58 | 1.81 | 0.54 | 0.54 | 1.53 | 0.41 | 2.97 | 0.84 |
| N-acetylisoleucine | ME448342 | 0.65 | 1.78 | 0.53 | 0.60 | 0.98 | 0.42 | 2.38 | 1.42 |
| N-acetylvaline | ME448358 | 0.95 | 1.71 | 0.64 | 0.56 | 0.64 | 0.72 | 2.27 | 0.99 |
| oleanolate | ME448409 | 0.63 | 0.64 | 1.59 | 1.39 | 0.05 | 0.25 | 3.37 | 0.06 |
| N-stearoyl-sphingosine (d18:1/18:0)* | ME448402 | 0.73 | 1.08 | 0.53 | 1.07 | 0.33 | 1.21 | 2.78 | 1.37 |
| ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)* | ME448041 | 0.90 | 0.92 | 0.67 | 1.11 | 0.47 | 0.89 | 3.20 | 1.12 |
| hexadecadienoate (16:2n6) | ME448201 | 0.59 | 1.26 | 0.63 | 1.09 | 0.37 | 0.72 | 2.86 | 1.01 |
| 1-palmitoyl-GPG (16:0)* | ME447789 | 0.91 | 0.73 | 1.57 | 0.97 | 0.36 | 0.68 | 2.72 | 0.85 |
| margarate (17:0) | ME448289 | 0.86 | 0.88 | 1.25 | 1.17 | 0.34 | 0.35 | 3.06 | 0.49 |
| linoleate (18:2n6) | ME448258 | 0.82 | 1.01 | 1.01 | 1.07 | 0.58 | 0.56 | 2.91 | 0.74 |
| nonadecanoate (19:0) | ME448392 | 0.72 | 1.07 | 1.03 | 1.17 | 0.39 | 0.44 | 2.82 | 0.51 |
| arachidonate (20:4n6) | ME447988 | 0.55 | 0.98 | 0.99 | 0.99 | 1.02 | 1.40 | 3.44 | 0.66 |
| 10-heptadecenoate (17:1n7) | ME447746 | 0.47 | 0.81 | 0.83 | 1.38 | 0.36 | 0.99 | 3.89 | 0.76 |
| docosapentaenoate (n3 DPA; 22:5n3) | ME448104 | 0.44 | 0.85 | 0.42 | 1.50 | 0.35 | 1.28 | 3.50 | 0.98 |
| 3-methyl-2-oxobutyrate | ME447880 | 0.82 | 0.64 | 1.36 | 1.58 | 1.22 | 0.42 | 3.83 | 0.39 |
| 17-methylstearate (i19:0) | ME447755 | 0.82 | 0.85 | 0.94 | 1.27 | 0.33 | 0.36 | 3.60 | 0.73 |
| 8-hydroxyguanine | ME447951 | 1.16 | 0.63 | 0.61 | 1.22 | 0.68 | 0.87 | 3.77 | 0.78 |
| trans-nonadecenoate (tr 19:1)* | ME448559 | 1.27 | 0.75 | 0.71 | 1.09 | 0.85 | 0.43 | 4.02 | 0.61 |
| putrescine | ME448480 | 1.30 | 0.96 | 1.08 | 0.19 | 0.44 | 0.86 | 5.15 | 2.05 |
| hyocholate | ME448217 | 0.96 | 0.74 | 0.72 | 0.98 | 1.19 | 1.59 | 4.71 | 1.29 |
| O-sulfo-L-tyrosine | ME448422 | 0.94 | 0.97 | 1.06 | 0.33 | 1.54 | 2.14 | 5.04 | 1.45 |
| valylglutamine | ME448591 | 0.71 | 0.81 | 0.69 | 0.97 | 1.47 | 2.99 | 2.28 | 0.58 |
| indolepropionate | ME448228 | 0.72 | 0.82 | 0.87 | 0.84 | 2.55 | 2.03 | 3.16 | 0.85 |
| phenylalanylalanine | ME448450 | 1.11 | 0.76 | 0.61 | 0.84 | 1.69 | 2.20 | 3.08 | 0.80 |
| N-methyl-GABA | ME448382 | 0.72 | 0.52 | 0.72 | 0.78 | 0.73 | 3.68 | 4.26 | 1.03 |
| dihomo-linoleate (20:2n6) | ME448088 | 0.39 | 0.99 | 0.62 | 1.04 | 0.70 | 2.34 | 4.40 | 0.47 |
| 3-dehydrocholate | ME447860 | 1.31 | 0.45 | 0.24 | 0.41 | 0.50 | 2.40 | 2.89 | 0.94 |
| anserine | ME447981 | 1.35 | 0.96 | 0.29 | 0.79 | 0.38 | 2.17 | 3.55 | 0.67 |
| 2-palmitoylglycerol (16:0) | ME447842 | 0.67 | 0.94 | 0.66 | 0.78 | 0.32 | 2.47 | 3.01 | 0.67 |
| 3-methylhistidine | ME447885 | 0.78 | 0.81 | 0.13 | 1.23 | 0.35 | 2.56 | 3.35 | 0.64 |
| glycyrrhetinate | ME448190 | 0.32 | 0.08 | NA | NA | 2.35 | NA | 3.55 | NA |
| 2-hydroxydecanoate | ME447824 | 0.56 | 1.05 | 0.75 | 0.76 | 2.86 | 1.34 | 3.36 | 1.04 |
| N6-formyllysine | ME448321 | 0.59 | 0.82 | 1.00 | 0.75 | 3.32 | 1.25 | 4.00 | 1.05 |
| ceramide (d18:2/24:1, d18:1/24:2)* | ME448042 | 0.92 | 0.78 | 0.62 | 0.98 | 1.99 | 0.75 | 4.05 | 1.15 |
| 2-linoleoylglycerol (18:2) | ME447833 | 0.69 | 0.96 | 1.01 | 0.99 | 2.10 | 0.32 | 3.97 | 0.51 |
| N-acetylphenylalanine | ME448348 | 0.99 | 1.07 | 0.82 | 0.72 | 2.59 | 0.40 | 3.64 | 0.93 |
| dehydrolithocholate | ME448073 | 0.94 | 0.60 | 0.67 | 1.29 | 3.16 | 0.79 | 5.02 | 0.98 |
| 1,2-dilinoleoyl-digalactosylglycerol (18:2/18:2)* | ME447739 | 0.76 | 0.68 | 1.00 | 0.58 | 3.88 | 0.55 | 4.49 | 1.72 |
| gamma-glutamylhistidine | ME448148 | 0.65 | 0.99 | 1.17 | 0.48 | 3.87 | 0.66 | 4.43 | 1.29 |
| creatinine | ME448060 | 1.71 | 0.20 | 1.04 | 0.90 | 1.75 | 0.29 | 4.11 | 1.94 |
| 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) | ME447783 | 1.51 | 0.52 | 0.89 | 0.67 | 1.76 | 1.51 | 2.78 | 2.05 |
| 1-linoleoyl-2-linolenoyl-digalactosylglycerol (18:2/18:3)* | ME447758 | 0.87 | 0.62 | 1.15 | 0.55 | 2.47 | 0.48 | 3.29 | 2.73 |
| 1-palmitoyl-2-linoleoyl-digalactosylglycerol (16:0/18:2)* | ME447780 | 0.78 | 0.85 | 0.87 | 0.87 | 2.37 | 0.62 | 2.47 | 2.08 |
| gamma-glutamylphenylalanine | ME448152 | 0.53 | 0.85 | 0.91 | 0.91 | 2.72 | 0.64 | 3.08 | 2.20 |
| S-carboxymethyl-L-cysteine | ME448505 | 0.47 | 0.53 | 1.34 | 0.47 | 1.95 | 1.10 | 4.00 | 3.46 |
| argininate* | ME447991 | 0.62 | 0.68 | 0.81 | 0.66 | 3.10 | 1.05 | 4.37 | 2.50 |
| salicylate | ME448502 | 1.22 | 0.64 | 0.63 | 0.60 | 2.34 | 1.27 | 4.26 | 2.17 |
| alpha-hydroxyisocaproate | ME447967 | 0.09 | 3.34 | 0.10 | 0.23 | 0.67 | 0.08 | 0.80 | 2.46 |
| chiro-inositol | ME448046 | 0.46 | 2.17 | 0.92 | 0.17 | 0.79 | 0.19 | 0.10 | 2.30 |
| fucitol | ME448134 | 0.78 | 3.96 | 1.72 | 0.57 | 0.80 | 0.48 | 0.41 | 1.22 |
| 2-hydroxy-3-methylvalerate | ME447820 | 0.24 | 2.98 | 0.18 | 0.38 | 0.51 | 0.19 | 1.71 | 1.35 |
| 3-(3-hydroxyphenyl)propionate sulfate | ME447846 | 0.47 | 3.17 | 0.43 | 0.57 | NA | 0.32 | 1.18 | 0.18 |
| eicosapentaenoate (EPA; 20:5n3) | ME448111 | 0.20 | 2.69 | 0.33 | 0.29 | 0.21 | 0.45 | 1.61 | 0.41 |
| N(1)-acetylspermine | ME448310 | 0.78 | 4.27 | 0.41 | 1.74 | NA | 0.28 | 0.61 | 0.31 |
| 4-acetamidobenzoate | ME447891 | 0.38 | 3.39 | 0.28 | 0.29 | 0.24 | 0.17 | 0.11 | 0.27 |
| secoisolariciresinol | ME448507 | 0.08 | 3.26 | 0.55 | 1.23 | NA | 0.11 | NA | 0.55 |
| alpha-tocopherol acetate | ME447972 | 3.36 | 0.01 | 2.25 | 0.05 | NA | 0.03 | 0.00 | 0.00 |
| 2^-deoxyadenosine | ME447814 | 2.91 | 0.58 | 0.75 | 0.46 | 1.04 | 1.29 | 1.06 | 0.83 |
| 5-hydroxylysine | ME447937 | 4.37 | 0.44 | 0.44 | 0.79 | 0.41 | 0.58 | 1.07 | 1.03 |
| 6-hydroxynicotinate | ME447942 | 3.50 | 0.31 | 0.45 | 0.63 | 0.32 | 0.86 | 0.41 | 0.91 |
| butyrylglycine | ME448020 | 3.09 | 0.44 | NA | 1.10 | 1.00 | NA | NA | 1.16 |
| 3-indoxyl sulfate | ME447878 | 2.62 | NA | 0.42 | 1.15 | NA | 0.10 | 0.05 | 0.03 |
| N-(2-furoyl)glycine | ME448311 | 3.68 | 0.08 | 0.13 | 1.07 | 0.07 | 0.06 | 0.06 | 0.06 |
| androstenediol (3beta,17beta) monosulfate (2) | ME447979 | 3.17 | 1.28 | 0.29 | 0.53 | NA | NA | NA | 0.08 |
| 1-methyl-beta-carboline-3-carboxylic acid | ME447765 | 2.38 | 0.96 | 0.49 | 1.42 | 0.05 | 0.04 | 0.09 | 0.05 |
| androstenediol (3alpha, 17alpha) monosulfate (2) | ME447975 | 2.20 | 1.38 | 0.52 | 1.03 | NA | 0.26 | 0.12 | 0.22 |
| 1,2-dilinoleoyl-galactosylglycerol (18:2/18:2)* | ME447740 | 0.78 | 0.71 | 1.14 | 0.56 | 2.17 | 0.59 | 1.11 | 3.43 |
| 2-hydroxybutyrate/2-hydroxyisobutyrate | ME447823 | 0.79 | 0.67 | 0.89 | 0.68 | 1.84 | 1.13 | 1.92 | 3.63 |
| 4-ethylphenylsulfate | ME447897 | NA | 0.88 | NA | 0.41 | 0.58 | 1.12 | NA | 2.00 |
| glycitein | ME448177 | 0.12 | 0.52 | NA | NA | 0.80 | 1.00 | NA | 1.87 |
| dexlansoprazole | ME448079 | NA | 0.08 | NA | 0.34 | NA | 2.21 | NA | 2.28 |
| metoprolol acid metabolite* | ME448300 | 0.53 | 0.24 | 0.50 | 0.32 | NA | 2.26 | NA | 2.15 |
| 1-(1-enyl-palmitoyl)-GPE (P-16:0)* | ME447733 | 1.33 | 0.47 | 1.22 | 0.69 | 1.69 | 1.52 | 0.45 | 2.85 |
| genistein | ME448156 | 0.97 | 0.21 | 1.33 | 0.47 | 1.00 | 1.50 | 0.24 | 3.38 |
| tyramine | ME448571 | 1.23 | 1.10 | 0.79 | 0.52 | 0.91 | 1.38 | 0.12 | 2.69 |
| 21-hydroxypregnenolone disulfate | ME447808 | 0.69 | 0.57 | 0.60 | 0.68 | 0.81 | 1.88 | NA | 3.18 |
| androstenediol (3beta,17beta) disulfate (1) | ME447976 | 1.05 | 0.71 | 0.52 | 0.73 | 0.40 | 2.09 | 0.39 | 2.67 |
| stachydrine | ME448523 | 0.70 | 1.01 | 0.53 | 0.68 | 0.33 | 1.19 | 0.90 | 4.52 |
| 1-palmitoyl-GPS (16:0)* | ME447791 | 1.05 | 0.37 | 0.44 | 1.01 | NA | 1.32 | 0.63 | 3.78 |
| 3-(4-hydroxyphenyl)lactate | ME447847 | 1.16 | 0.62 | 0.77 | 0.87 | 0.38 | 0.79 | 0.85 | 3.99 |
| xylose | ME448600 | 0.98 | 0.80 | 1.15 | 0.77 | 0.58 | 0.85 | 0.55 | 3.82 |
| gamma-glutamylglycine | ME448147 | 1.29 | 0.25 | 1.19 | 0.74 | 0.59 | NA | 0.28 | 3.38 |
| 1-palmitoyl-2-linoleoyl-galactosylglycerol (16:0/18:2)* | ME447781 | 0.79 | 0.85 | 0.71 | 1.00 | 0.71 | 0.76 | 0.90 | 2.91 |
| dihydroferulic acid | ME448093 | 0.83 | 0.87 | 0.78 | 1.03 | 0.53 | 0.71 | 0.64 | 3.06 |
| furaneol sulfate | ME448137 | 0.45 | 1.01 | 0.88 | 0.97 | 0.27 | 1.11 | NA | 2.82 |
| thioproline | ME448551 | 0.63 | 1.06 | 0.54 | 1.11 | 0.91 | 0.61 | NA | 2.77 |
| 2-aminophenol sulfate | ME447813 | 1.07 | 0.51 | 0.86 | 1.29 | NA | 0.85 | 0.14 | 2.94 |
| 11-ketoetiocholanolone sulfate | ME447748 | 1.17 | 0.51 | 1.67 | 0.69 | 0.29 | 1.07 | 0.32 | 3.08 |
| 2-keto-3-deoxy-gluconate | ME447832 | 1.13 | 0.60 | 1.41 | 0.82 | 0.40 | 1.11 | 0.60 | 2.65 |
| daidzein | ME448070 | 0.67 | 0.52 | 0.92 | 0.68 | 1.04 | 2.98 | 0.20 | 4.25 |
| 2-(4-hydroxyphenyl)propionate | ME447799 | 0.31 | 1.25 | 0.24 | 0.36 | NA | 2.09 | NA | 3.48 |
| tryptamine | ME448567 | 1.35 | 0.80 | 0.27 | 0.46 | NA | 1.71 | NA | 3.59 |
| vanillactate | ME448594 | 0.91 | 0.72 | 0.60 | 0.56 | NA | 2.07 | NA | 4.13 |
| 1,2-dipalmitoyl-GPC (16:0/16:0) | ME447742 | 0.75 | 0.47 | 2.67 | 0.51 | 2.69 | 0.87 | 1.72 | 0.56 |
| cadaverine | ME448021 | 3.26 | 0.27 | 1.89 | 0.19 | 0.50 | 0.32 | 2.04 | 0.47 |
| 3-(4-hydroxyphenyl)propionate | ME447848 | 2.33 | 0.39 | 1.39 | 0.56 | 2.40 | 0.48 | 1.94 | 0.64 |
| N1,N12-diacetylspermine | ME448313 | 1.88 | 0.45 | 1.44 | 0.77 | 1.37 | 0.64 | 2.01 | 0.97 |
| eriodictyol | ME448118 | 0.94 | 0.42 | NA | NA | 0.33 | 2.37 | NA | NA |
| oleoylcholine | ME448413 | 1.82 | NA | NA | 0.60 | 0.97 | 1.43 | 0.18 | NA |
| 1-palmitoyl-2-linolenoyl-digalactosylglycerol (16:0/18:3) | ME447779 | 1.24 | 0.32 | 0.37 | 0.92 | 0.52 | 0.16 | 2.07 | 3.59 |
| caproate (6:0) | ME448027 | 0.60 | 0.66 | 0.48 | 1.47 | 0.47 | 0.67 | 2.11 | 2.70 |
| phytanate | ME448459 | 0.32 | 0.74 | 0.54 | 1.95 | 0.22 | 0.23 | 1.67 | 1.67 |
| pristanate | ME448471 | 0.60 | 0.99 | 0.38 | 1.26 | 0.37 | 0.32 | 2.26 | 1.72 |
| ponciretin | ME448466 | 1.50 | 0.09 | 1.35 | 0.16 | 0.25 | 2.21 | 0.52 | 1.49 |
| 2^-deoxycytidine | ME447816 | 1.40 | 0.52 | 1.70 | 0.50 | 0.50 | 2.22 | 0.92 | 1.83 |
| 4-acetamidobutanoate | ME447892 | 1.39 | 0.56 | 1.80 | 0.60 | 0.47 | 2.00 | 0.66 | 1.35 |
| nicotinate ribonucleoside | ME448379 | 1.03 | 0.69 | 1.49 | 0.69 | 0.80 | 1.81 | 0.20 | 2.16 |
| prolylglycine | ME448473 | 1.03 | 0.70 | 1.85 | 0.59 | 0.82 | 1.37 | 1.07 | 2.11 |
| piperidine | ME448464 | 1.71 | 0.83 | 1.51 | 0.57 | 0.11 | 0.64 | 0.16 | 1.98 |
| epicatechin | ME448116 | 2.16 | 0.41 | 0.84 | 0.30 | NA | 1.10 | 0.32 | 2.19 |
| nicotianamine | ME448375 | 1.94 | 0.59 | 1.24 | 0.56 | 0.69 | 1.20 | 0.34 | 2.60 |
| 3-methylglutaconate | ME447883 | 1.67 | NA | 1.27 | 0.45 | NA | 1.26 | NA | 0.89 |
| 2-methylcitrate/homocitrate | ME447835 | 1.09 | 0.83 | 1.25 | 0.86 | 0.12 | 1.77 | 0.17 | 1.26 |
| alpha-CEHC sulfate | ME447966 | 0.73 | 0.66 | 1.15 | 0.99 | NA | 1.47 | NA | 1.26 |
| 2-aminophenol | ME447812 | 1.30 | 0.62 | 1.12 | 1.04 | 0.24 | 1.27 | 0.32 | 1.91 |
| N-acetylaspartate (NAA) | ME448328 | 1.43 | 0.75 | 1.05 | 0.92 | 0.01 | 1.39 | 0.02 | 1.53 |
| xanthurenate | ME448599 | 1.85 | 0.86 | 0.86 | 0.94 | 0.16 | 1.27 | NA | 1.62 |
| thymidine 5^-monophosphate | ME448558 | 2.02 | 0.84 | 0.93 | 1.11 | 2.07 | 0.16 | 0.96 | 0.27 |
| 2^-deoxyadenosine 5^-monophosphate | ME447815 | 1.32 | 0.79 | 0.91 | 1.47 | 1.91 | 0.14 | 0.58 | 0.21 |
| 2^-deoxycytidine 5^-monophosphate | ME448071 | 1.21 | 0.83 | 0.86 | 1.43 | 2.25 | 0.15 | 0.80 | 0.37 |
| 1,2-dilinoleoyl-GPC (18:2/18:2) | ME447741 | 1.59 | 0.69 | 1.74 | 0.74 | 1.95 | 0.27 | 0.96 | 0.32 |
| 4-hydroxycyclohexylcarboxylic acid | ME447903 | 0.75 | 1.33 | 1.45 | 0.72 | 2.07 | 0.47 | 0.79 | 0.27 |
| 3b-hydroxy-5-cholenoic acid | ME447857 | 0.98 | 1.46 | 0.57 | 0.93 | 1.54 | 0.47 | 0.90 | 0.54 |
| N-acetyl-1-methylhistidine* | ME448323 | 0.94 | 1.42 | 0.41 | 1.05 | 1.46 | 0.84 | 0.31 | 0.55 |
| 3,4-dihydroxyphenylacetate | ME447852 | 0.88 | 1.07 | 1.12 | 1.20 | 1.49 | 0.53 | NA | 0.23 |
| ibuprofen | ME448219 | 0.65 | 1.29 | 1.10 | 1.07 | 1.80 | NA | 0.32 | 0.12 |
| adenosine 5^-monophosphate (AMP) | ME447974 | 0.69 | 1.02 | 0.84 | 1.47 | 1.37 | 0.44 | 0.76 | 0.46 |
| phosphate | ME448455 | 1.01 | 0.90 | 0.95 | 1.55 | 0.87 | 0.43 | 0.29 | 0.20 |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]* | ME448435 | 1.12 | 0.64 | 1.33 | 1.16 | 2.36 | 0.83 | 0.76 | 0.45 |
| palmitoyl-oleoyl-glycerol (16:0/18:1) [2]* | ME448437 | 0.87 | 0.54 | 1.07 | 1.46 | 1.86 | 1.32 | 0.55 | 0.62 |
| tyrosol | ME448574 | 0.90 | 0.73 | 0.59 | 1.45 | 2.21 | 0.99 | 0.94 | 0.49 |
| glucose | ME448160 | 0.72 | 0.82 | 1.52 | 0.81 | 1.46 | 1.79 | 0.49 | 1.25 |
| dihydrocaffeate | ME448092 | 1.00 | 0.98 | 1.00 | 1.00 | 1.78 | 1.36 | 0.59 | 0.58 |
| isocaproate (i6:0) | ME448232 | 0.92 | 0.94 | 0.91 | 0.88 | 1.50 | 1.84 | 0.80 | 0.64 |
| bilirubin (Z,Z) | ME448012 | 1.20 | 0.97 | 0.71 | 1.13 | 1.20 | 1.11 | 0.04 | 1.04 |
| biliverdin | ME448015 | 1.33 | 0.97 | 0.97 | 0.93 | 1.12 | 1.08 | 0.13 | 0.75 |
| kynurenine | ME448240 | 1.43 | 0.89 | 1.04 | 0.76 | 1.55 | 0.89 | 0.91 | 1.25 |
| N1-Methyl-2-pyridone-5-carboxamide | ME448314 | 1.69 | 0.92 | 0.91 | 0.85 | 1.56 | 0.92 | 1.07 | 0.91 |
| palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]* | ME448436 | 1.09 | 0.73 | 1.38 | 1.09 | 1.54 | 0.95 | 0.44 | 0.70 |
| glycerol 3-phosphate | ME448170 | 1.21 | 0.86 | 1.03 | 1.23 | 1.56 | 0.45 | 0.43 | 0.52 |
| N-delta-acetylornithine | ME448367 | 1.33 | 0.97 | 1.00 | 0.99 | 1.48 | 0.53 | 0.91 | 0.59 |
| 2-isopropylmalate | ME447831 | 1.28 | 0.22 | 2.85 | 0.47 | 0.34 | 1.59 | 0.42 | 1.66 |
| lactobionate | ME448242 | 1.11 | 0.61 | 2.24 | 0.55 | 0.28 | 0.93 | 0.24 | 1.70 |
| carnitine | ME448032 | 0.65 | 0.65 | 2.64 | 0.75 | 0.35 | 0.95 | 0.66 | 1.03 |
| fructose | ME448133 | 0.61 | 0.54 | 2.92 | 0.50 | 0.51 | 1.02 | 0.54 | 1.75 |
| N-acetylthreonine | ME448355 | 0.33 | 0.99 | 1.75 | 0.83 | 0.58 | 1.14 | 0.76 | 1.39 |
| glutarate (C5-DC) | ME448167 | 0.63 | 1.02 | 2.05 | 0.81 | 0.09 | 1.25 | 0.39 | 0.83 |
| maltose | ME448284 | 1.00 | 0.73 | 1.99 | 0.79 | 0.58 | 1.62 | 0.32 | 0.63 |
| myristoylcarnitine (C14) | ME448308 | 1.16 | 1.03 | 1.72 | 0.42 | 0.47 | 1.36 | 0.32 | 0.92 |
| 4-hydroxyhippurate | ME447905 | 1.06 | 0.12 | 1.95 | 1.36 | 0.59 | 0.37 | NA | 1.65 |
| cinnamate | ME448053 | 1.33 | 0.49 | 1.64 | 1.97 | 0.52 | 0.64 | 0.36 | 1.04 |
| 15-methylpalmitate (i17:0) | ME447753 | 1.33 | 0.86 | 1.51 | 1.01 | 0.36 | 0.27 | 1.52 | 0.50 |
| glycosyl ceramide (d18:1/20:0, d16:1/22:0)* | ME448183 | 0.92 | 1.05 | 1.85 | 1.00 | NA | 0.33 | 1.60 | 0.29 |
| 2-hydroxybehenate | ME447822 | 0.99 | 1.14 | 1.08 | 1.22 | 0.49 | 0.27 | 0.85 | 0.27 |
| N-methylpipecolate | ME448387 | 1.35 | 0.96 | 1.13 | 1.12 | 0.42 | 0.35 | 0.75 | 0.52 |
| N-acetylpyrraline | ME448351 | 0.92 | 1.16 | 1.64 | 1.23 | 0.34 | 0.49 | 0.40 | 0.16 |
| trigonelline (N^-methylnicotinate) | ME448565 | 0.91 | 0.83 | 1.69 | 1.22 | 0.43 | 0.26 | 1.01 | 0.28 |
| taurodeoxycholate | ME448543 | 0.35 | 0.80 | 1.62 | 1.21 | NA | 0.06 | NA | 0.75 |
| catechol sulfate | ME448037 | 0.55 | 1.05 | 1.83 | 1.37 | NA | 0.36 | 0.22 | 0.23 |
| serotonin | ME448511 | 0.40 | 0.67 | 2.08 | 1.41 | 0.08 | 0.57 | 0.09 | 0.26 |
| galacturonate | ME448140 | 1.35 | 0.52 | 2.26 | 0.93 | 0.09 | 0.47 | 0.43 | 0.70 |
| oxalate (ethanedioate) | ME448423 | 1.32 | 0.81 | 2.38 | 0.62 | 0.14 | 0.79 | 0.31 | 0.38 |
| p-cresol | ME448441 | 1.42 | 0.90 | 1.91 | 0.75 | 0.50 | 0.80 | 0.40 | 0.68 |
| 2,3-dihydroxyisovalerate | ME447801 | 1.27 | 0.63 | 1.99 | 0.92 | 0.75 | 0.54 | 0.53 | 0.61 |
| 2-oxo-1-pyrrolidinepropionate | ME447840 | 1.21 | 0.84 | 1.80 | 0.97 | 0.59 | 0.65 | 0.63 | 0.44 |
| 1-linolenoylglycerol (18:3) | ME447757 | 1.37 | 0.78 | 1.75 | 0.99 | 0.18 | 0.24 | 0.71 | 0.63 |
| laurate (12:0) | ME448248 | 1.77 | 0.74 | 1.86 | 0.67 | 0.12 | 0.57 | 0.63 | 0.59 |
| dihydoxyphenylalanine (L-DOPA) | ME448091 | 0.93 | 0.90 | 2.09 | 0.97 | 0.17 | 0.54 | 0.33 | 0.87 |
| 13-HOTrE | ME447752 | 0.99 | 1.12 | 1.94 | 0.78 | NA | 0.23 | 0.54 | 0.62 |
| linolenate [alpha or gamma; (18:3n3 or 6)] | ME448259 | 0.82 | 0.95 | 1.86 | 1.08 | 0.06 | 0.23 | 0.39 | 0.71 |
| 2-oxindole-3-acetate | ME447839 | 1.42 | 1.15 | 1.73 | 0.65 | 0.07 | 0.40 | 0.03 | 1.05 |
| indole | ME448222 | 1.16 | 1.15 | 1.81 | 0.71 | NA | 0.65 | NA | 0.36 |
| carboxyibuprofen | ME448031 | 0.86 | 0.91 | 1.98 | 1.16 | 0.87 | NA | 0.16 | 0.30 |
| arabitol/xylitol | ME447985 | 0.66 | 0.41 | 2.29 | 1.01 | 0.88 | 0.40 | 0.43 | 1.33 |
| diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])* | ME448083 | 0.75 | 0.63 | 1.87 | 1.30 | 0.77 | 0.55 | 0.41 | 0.74 |
| erythrose | ME448122 | 0.80 | 0.75 | 2.12 | 0.96 | 0.71 | 0.50 | 0.37 | 1.03 |
| diacetylchitobiose | ME448082 | 0.29 | 0.94 | 0.28 | 1.45 | NA | NA | NA | 2.26 |
| diosmetin | ME448098 | 0.34 | NA | NA | 1.49 | 0.40 | 0.14 | 0.12 | 2.08 |
| S-allylcysteine | ME448503 | NA | 0.60 | 0.26 | 1.20 | NA | 0.92 | NA | 1.61 |
| protoporphyrin IX | ME448476 | 0.98 | 0.83 | 0.52 | 1.56 | 0.03 | 0.65 | 0.11 | 1.37 |
| 2,4-dihydroxyhydrocinnamate | ME447804 | 1.32 | 0.75 | 0.57 | 1.18 | NA | 0.58 | NA | 1.99 |
| orotate | ME448420 | 1.24 | 0.92 | 0.65 | 1.23 | 0.19 | 0.65 | 0.30 | 1.69 |
| L-urobilin | ME448275 | 0.66 | 1.06 | 0.78 | 1.14 | NA | 0.79 | 0.02 | 2.04 |
| N-methylproline | ME448388 | 0.66 | 1.03 | 0.43 | 1.54 | 0.33 | 0.68 | 0.29 | 1.75 |
| N-stearoyl-sphinganine (d18:0/18:0)* | ME448401 | 0.54 | 1.15 | 0.45 | 1.40 | 0.22 | 1.05 | 0.50 | 1.63 |
| 3-hydroxypyridine | ME447873 | 1.36 | 0.78 | 0.72 | 1.31 | 0.86 | 0.57 | 1.94 | 0.53 |
| 3-methyl-2-oxovalerate | ME447881 | 0.80 | 0.69 | 1.39 | 1.60 | 0.40 | 0.51 | 1.73 | 0.55 |
| 4-hydroxyphenylpyruvate | ME447907 | 0.73 | 0.83 | 1.07 | 1.41 | 0.87 | 0.72 | 2.14 | 0.82 |
| stearate (18:0) | ME448524 | 0.78 | 1.06 | 1.04 | 1.18 | 0.50 | 0.51 | 2.26 | 0.49 |
| 1-methylurate | ME447770 | 1.02 | 0.94 | 0.61 | 1.41 | 0.14 | 0.70 | 2.03 | 0.55 |
| 3-hydroxypalmitate | ME447871 | 0.70 | 1.40 | 0.42 | 1.40 | 0.01 | 1.01 | 1.99 | 0.23 |
| 5-acetylamino-6-formylamino-3-methyluracil | ME447916 | 1.22 | 1.42 | 0.60 | 1.11 | 0.12 | 0.22 | 1.29 | 0.47 |
| hexadecatrienoate (16:3n3) | ME448205 | 0.91 | 1.38 | 0.29 | 1.21 | 0.26 | 0.39 | 1.68 | 0.52 |
| 2-hydroxypalmitate | ME447829 | 1.06 | 1.13 | 1.06 | 1.15 | 0.57 | 0.18 | 1.70 | 0.37 |
| docosadienoate (22:2n6) | ME448102 | 0.99 | 1.28 | 1.00 | 1.05 | 0.32 | 0.27 | 1.78 | 0.24 |
| 2-hydroxylaurate | ME447828 | 0.99 | 1.10 | 1.03 | 1.05 | 0.58 | 0.51 | 1.49 | 0.71 |
| 6-oxolithocholate | ME447943 | 0.72 | 1.23 | 1.01 | 1.10 | 0.47 | 0.55 | 1.50 | 0.60 |
| 1-methylxanthine | ME447771 | 0.97 | 1.24 | 0.70 | 1.13 | 0.16 | 0.74 | 1.59 | 0.92 |
| N-trimethyl 5-aminovalerate | ME448404 | 0.89 | 1.17 | 0.69 | 1.15 | 0.52 | 0.73 | 1.66 | 0.76 |
| S-methylcysteine | ME448516 | 0.60 | 1.22 | 1.48 | 0.70 | 0.81 | 0.56 | 1.69 | 1.21 |
| myristate (14:0) | ME448306 | 0.87 | 0.75 | 1.56 | 1.06 | 0.37 | 0.55 | 1.75 | 1.19 |
| N-acetylglucosaminylasparagine | ME448336 | 0.74 | 0.79 | 1.32 | 1.05 | 0.90 | 0.87 | 1.84 | 1.36 |
| N-acetylneuraminate | ME448347 | 0.82 | 0.84 | 1.25 | 1.08 | 0.68 | 0.54 | 2.20 | 1.17 |
| 7-methylxanthine | ME447950 | 1.54 | 0.58 | 1.12 | 0.91 | NA | 0.86 | 1.61 | 1.10 |
| 1-stearoyl-GPG (18:0) | ME447796 | 1.05 | 0.91 | 0.90 | 1.03 | 0.25 | 0.91 | 1.80 | 1.13 |
| N-propionylalanine | ME448399 | 1.24 | 1.12 | 0.61 | 0.88 | 0.52 | 1.13 | 1.78 | 1.10 |
| glutamyl-meso-diaminopimelate | ME448166 | 0.85 | 1.19 | 0.74 | 1.88 | NA | 0.65 | 1.01 | 0.85 |
| margaroylcarnitine (C17)* | ME448290 | 0.60 | 1.00 | 0.56 | 1.61 | 0.23 | 1.02 | 1.35 | 0.96 |
| 1,7-dimethylurate | ME447745 | 0.93 | 1.17 | 0.46 | 1.22 | 0.09 | 0.73 | 1.38 | 1.18 |
| N-formylanthranilic acid | ME448371 | 1.07 | 1.04 | 0.65 | 1.27 | 0.21 | 0.72 | 0.97 | 0.92 |
| N-acetyl-3-methylhistidine* | ME448324 | 1.60 | 0.90 | 0.27 | 1.19 | 0.23 | 1.18 | 1.07 | 0.58 |
| linoleoyl ethanolamide | ME448263 | 1.44 | 0.75 | 0.80 | 1.49 | 0.03 | 0.84 | 0.79 | 0.36 |
| mevalonate 5-diphosphate | ME448302 | 1.20 | 1.02 | 0.98 | 1.27 | NA | 0.52 | 1.09 | 0.47 |
| methyl indole-3-acetate | ME448296 | 0.64 | 1.08 | 1.67 | 1.21 | NA | 0.66 | NA | 1.44 |
| beta-cryptoxanthin | ME448006 | 0.57 | 1.59 | 1.01 | 0.83 | 0.10 | 0.54 | 0.16 | 1.43 |
| hydroxymethylpyrimidine | ME448215 | 0.71 | 1.59 | 0.97 | 0.81 | 0.46 | 0.29 | 0.65 | 1.18 |
| 5alpha-androstan-3beta,17alpha-diol monosulfate (2) | ME447923 | 1.50 | 1.37 | 0.39 | 1.03 | NA | 0.37 | NA | 1.10 |
| 5-hydroxyhexanoate | ME447936 | 1.12 | 1.05 | 1.45 | 0.92 | 0.14 | 0.37 | 0.73 | 1.27 |
| 2,3-dimethylsuccinate | ME447802 | 1.10 | 1.03 | 1.22 | 0.95 | NA | 0.52 | 0.61 | 0.82 |
| dopamine | ME448106 | 1.06 | 1.04 | 1.43 | 1.01 | 0.24 | 0.61 | 0.55 | 0.52 |
| 1,3-dimethylurate | ME447744 | 0.81 | 1.26 | 0.98 | 1.06 | NA | 0.47 | 0.90 | 0.85 |
| quinate | ME448488 | 0.94 | 1.09 | 1.18 | 1.00 | 0.10 | 0.73 | 0.90 | 1.08 |
| 2-aminoadipate | ME447810 | 1.04 | 1.11 | 0.75 | 1.11 | 0.26 | 1.15 | 0.53 | 0.89 |
| N-acetylglutamate | ME448337 | 1.14 | 1.12 | 0.94 | 0.96 | 0.25 | 1.15 | 0.31 | 0.98 |
| lanosterol | ME448247 | 0.93 | 1.12 | 1.02 | 1.06 | 0.37 | 0.92 | 0.67 | 0.87 |
| behenoylcarnitine (C22)* | ME448001 | 1.12 | 1.07 | 1.03 | 1.02 | 0.40 | 1.16 | 0.44 | 0.67 |
| oleoyl ethanolamide | ME448411 | 1.01 | 1.22 | 0.97 | 1.04 | 0.33 | 0.95 | 0.48 | 0.57 |
| palmitoyl ethanolamide | ME448430 | 0.96 | 1.17 | 0.98 | 1.08 | 0.31 | 1.00 | 0.34 | 0.71 |
| 16a-hydroxy DHEA 3-sulfate | ME447754 | 1.13 | 1.31 | 0.74 | 1.02 | NA | 0.98 | 0.20 | 0.85 |
| 3-methylglutarate/2-methylglutarate | ME447884 | 1.06 | 1.09 | 1.08 | 1.01 | 0.05 | 0.92 | 0.27 | 0.85 |
| tricarballylate | ME448563 | 1.00 | 1.25 | 0.95 | 1.06 | 0.16 | 0.95 | 0.06 | 0.66 |
| 4-hydroxybenzyl alcohol | ME447900 | 1.16 | 0.90 | 0.78 | 1.01 | NA | 1.26 | NA | 0.90 |
| methylsuccinate | ME448299 | 1.21 | 1.15 | 1.04 | 0.92 | 0.04 | 1.22 | 0.07 | 0.75 |
| 3,5-dihydroxybenzoic acid | ME447853 | 1.45 | 0.80 | 1.08 | 1.09 | 0.56 | 0.94 | NA | 0.93 |
| dimethylmalonic acid | ME448097 | 1.08 | 0.95 | 1.11 | 0.95 | NA | 0.92 | NA | 1.04 |
| fumarate | ME448136 | 1.22 | 0.91 | 1.23 | 0.89 | 0.10 | 1.01 | 0.09 | 1.23 |
| pimelate (C7-DC) | ME448462 | 1.29 | 0.83 | 1.08 | 1.03 | 0.31 | 1.07 | 0.49 | 0.95 |
| alpha-tocopherol | ME447971 | 1.46 | 0.97 | 1.23 | 0.89 | 0.22 | 0.86 | 0.43 | 0.74 |
| N-carbamoylglutamate | ME448365 | 1.36 | 0.71 | 1.15 | 1.01 | NA | 0.94 | 0.27 | 0.81 |
| undecanedioate (C11-DC) | ME448576 | 1.16 | 1.33 | 0.78 | 0.84 | 0.18 | 0.93 | 0.27 | 1.21 |
| 4-hydroxyglutamate | ME447904 | 1.45 | 0.89 | 0.91 | 0.89 | NA | 1.03 | 0.43 | 1.24 |
| maltol | ME448283 | 1.19 | 0.97 | 0.89 | 0.94 | NA | 0.92 | 0.47 | 1.47 |
| homocitrulline | ME448211 | 1.24 | 1.04 | 0.95 | 0.95 | 0.25 | 0.99 | 0.43 | 1.48 |
| pyridoxate | ME448483 | 1.19 | 0.99 | 1.09 | 0.87 | 0.30 | 1.14 | 0.39 | 1.45 |
| hexadecanedioate (C16-DC) | ME448202 | 0.80 | 1.17 | 0.69 | 1.05 | 0.33 | 1.36 | 0.27 | 1.46 |
| 3-hydroxysuberate | ME447876 | 0.94 | 0.95 | 0.84 | 1.07 | NA | 1.31 | 0.52 | 1.26 |
| hydantoin-5-propionic acid | ME448213 | 0.81 | 0.91 | 0.87 | 1.23 | 0.31 | 1.22 | 0.72 | 1.11 |
| 1-methylimidazoleacetate | ME447768 | 1.40 | 0.97 | 0.69 | 1.14 | 0.38 | 0.82 | 0.57 | 1.03 |
| carotene diol (1) | ME448034 | 1.18 | 1.28 | 0.62 | 1.05 | 0.27 | 0.49 | 0.50 | 1.15 |
| glutamate, gamma-methyl ester | ME448163 | 1.07 | 0.91 | 1.12 | 1.03 | 0.63 | 0.90 | 0.55 | 1.31 |
| quinolinate | ME448490 | 1.05 | 0.87 | 1.07 | 1.13 | 0.41 | 0.84 | 0.31 | 1.33 |
| nicotinamide | ME448376 | 0.74 | 1.16 | 0.98 | 1.16 | 0.44 | 0.58 | 0.63 | 1.17 |
| suberate (C8-DC) | ME448530 | 0.98 | 1.08 | 0.93 | 1.15 | 0.32 | 0.64 | 0.29 | 1.24 |
| caffeine | ME448024 | 0.66 | 0.97 | 1.02 | 1.33 | 0.08 | 0.89 | 0.52 | 1.50 |
| N-acetylcysteine | ME448333 | 0.92 | 0.90 | 1.05 | 1.29 | NA | 0.66 | 0.29 | 1.01 |
| theophylline | ME448549 | 0.79 | 0.99 | 0.86 | 1.32 | NA | 0.74 | 0.56 | 0.96 |
| 3-aminoisobutyrate | ME447855 | 1.58 | 0.99 | 0.90 | 1.17 | 0.52 | 0.56 | 0.49 | 0.50 |
| 4-cholesten-3-one | ME447896 | 1.37 | 0.98 | 0.84 | 1.27 | 0.23 | 0.63 | 0.24 | 0.48 |
| dipicolinate | ME448101 | 1.38 | 1.18 | 1.06 | 0.93 | NA | 0.38 | 0.12 | 0.47 |
| octadecanedioate (C18-DC) | ME448407 | 1.34 | 1.13 | 1.08 | 0.89 | 0.33 | 0.32 | NA | 0.58 |
| azelate (C9-DC) | ME447997 | 1.21 | 1.05 | 1.14 | 1.07 | 0.25 | 0.56 | 0.26 | 0.79 |
| sebacate (C10-DC) | ME448506 | 1.19 | 1.04 | 1.09 | 1.04 | 0.23 | 0.61 | 0.35 | 0.66 |
| carotene diol (2) | ME448035 | 1.19 | 1.23 | 0.89 | 1.01 | 0.32 | 0.48 | 0.37 | 0.88 |
| carotene diol (3) | ME448036 | 1.17 | 1.28 | 0.84 | 1.05 | 0.15 | 0.48 | 0.22 | 0.84 |
| beta-muricholate | ME448010 | 1.14 | 1.13 | 0.97 | 1.13 | 0.15 | 0.48 | 0.05 | 0.56 |
| indolin-2-one | ME448229 | 1.15 | 1.24 | 0.90 | 1.06 | 0.30 | 0.35 | 0.13 | 0.70 |
| 3-methyladipate | ME447882 | 1.29 | 1.25 | 0.61 | 1.05 | NA | 0.46 | 0.07 | 0.50 |
| 5alpha-androstan-3beta,17beta-diol monosulfate (1) | ME447925 | 1.08 | 1.14 | 0.60 | 1.06 | NA | 0.61 | NA | 1.06 |
| flavin mononucleotide (FMN) | ME448131 | 1.23 | 0.98 | 0.76 | 1.08 | NA | 0.61 | NA | 0.82 |
| 5-hydroxymethylfurfural | ME447938 | 0.94 | 1.58 | 0.88 | 0.81 | NA | 0.31 | 0.48 | 0.78 |
| sitostanol | ME448514 | 0.84 | 1.47 | 0.70 | 0.93 | NA | 0.59 | 0.13 | 0.96 |
| xanthosine | ME448598 | 0.71 | 1.23 | 0.99 | 1.23 | 0.25 | 0.63 | 0.52 | 0.47 |
| delta-tocopherol | ME448074 | 0.77 | 1.27 | 0.93 | 1.15 | 0.17 | 0.81 | 0.45 | 0.72 |
| gamma-tocopherol/beta-tocopherol | ME448154 | 0.83 | 1.29 | 0.91 | 1.15 | 0.20 | 0.65 | 0.49 | 0.67 |
| 5-acetylamino-6-amino-3-methyluracil | ME447915 | 0.88 | 1.22 | 0.72 | 1.31 | NA | 0.22 | 0.43 | 0.45 |
| palmitoylcholine | ME448433 | 0.73 | 1.21 | 1.01 | 1.19 | 0.11 | 0.37 | 0.27 | 0.51 |
| coprostanol | ME448058 | 0.72 | 1.60 | 0.87 | 0.96 | NA | 0.51 | 0.11 | 0.47 |
| 3-carboxyadipate | ME447859 | 0.98 | 1.30 | 1.18 | 1.08 | 0.05 | 0.32 | 0.07 | 0.30 |
| 4-oxo-retinoic acid | ME447912 | 0.88 | 1.18 | 1.13 | 0.94 | NA | 0.45 | NA | 0.59 |
| 5alpha-androstan-3beta,17alpha-diol monosulfate (1) | ME447922 | 0.86 | 1.30 | 1.26 | 0.94 | NA | 0.45 | NA | 0.67 |
| guanosine-2^,3^-cyclic monophosphate | ME448194 | 0.94 | 1.38 | 0.58 | 0.86 | NA | NA | 0.38 | 0.40 |
| dihydroorotate | ME448094 | 1.11 | 1.13 | 0.44 | 1.52 | 0.12 | 0.22 | 0.33 | 0.46 |
| paraxanthine | ME448440 | 0.97 | 1.04 | 0.48 | 1.31 | NA | 0.50 | 0.54 | 0.73 |
| epiandrosterone sulfate | ME448115 | 1.07 | 1.65 | 0.37 | 1.10 | 0.64 | 1.02 | 1.07 | 0.76 |
| pterin | ME448479 | 1.05 | 1.25 | 0.58 | 1.18 | 0.72 | 0.51 | 0.21 | 0.54 |
| 3,4-dihydroxybenzoate | ME447851 | 0.92 | 1.62 | 0.78 | 0.85 | 0.51 | 0.42 | 0.89 | 0.55 |
| biotin | ME448017 | 0.92 | 1.31 | 0.64 | 1.14 | 0.56 | 0.45 | 0.84 | 0.52 |
| 1-methylguanidine | ME447766 | 0.97 | 1.33 | 0.56 | 1.22 | 0.28 | 0.64 | 0.59 | 0.60 |
| stearoyl ethanolamide | ME448526 | 0.86 | 1.23 | 0.64 | 1.27 | 0.50 | 0.76 | 0.72 | 0.65 |
| enterolactone | ME448114 | 0.41 | 1.41 | 0.79 | 1.38 | 0.09 | 0.86 | 0.16 | 0.41 |
| anthranilate | ME447982 | 0.59 | 1.10 | 0.96 | 1.07 | NA | 0.81 | NA | NA |
| caffeate | ME448022 | 0.73 | 1.47 | 1.15 | 0.81 | 0.19 | 1.01 | NA | 0.21 |
| 3-hydroxycinnamate | ME447864 | 0.83 | 1.26 | NA | 1.16 | NA | 0.85 | 0.32 | 0.77 |
| cholate sulfate | ME448048 | 1.31 | 1.59 | 0.47 | 1.20 | 0.05 | 0.86 | 0.39 | 0.37 |
| p-cresol sulfate | ME448442 | 1.04 | 1.08 | 0.57 | 1.40 | 0.10 | 1.26 | 0.20 | 0.27 |
| 5alpha-androstan-3beta,17alpha-diol disulfate | ME447921 | 1.28 | 1.04 | 0.35 | 1.39 | NA | 1.00 | NA | 0.63 |
| ursodeoxycholate sulfate (1) | ME448583 | 1.03 | 1.12 | 0.49 | 1.38 | NA | 1.03 | 0.06 | 0.48 |
| S-methylmethionine | ME448517 | 0.69 | 1.42 | 1.28 | 0.68 | 1.21 | 1.24 | 0.55 | 0.22 |
| palmitoleoylcarnitine (C16:1)* | ME448427 | 0.47 | 1.48 | 1.23 | 0.79 | 0.45 | 0.85 | 0.51 | 0.75 |
| linoleoylcarnitine (C18:2)* | ME448265 | 0.93 | 1.20 | 1.44 | 0.77 | 0.93 | 0.72 | 0.74 | 0.97 |
| valine betaine | ME448589 | 0.86 | 1.09 | 1.44 | 1.00 | 0.63 | 0.96 | 0.39 | 0.66 |
| 3-sulfo-L-alanine | ME447889 | 0.58 | 1.06 | 0.74 | 1.12 | 0.38 | 1.17 | 1.60 | 1.56 |
| ceramide (d18:1/14:0, d16:1/16:0)* | ME448039 | 0.53 | 0.98 | 0.72 | 1.23 | 0.98 | 1.05 | 1.57 | 1.59 |
| cis-4-hydroxycyclohexylacetic acid | ME448054 | 0.65 | 1.16 | 0.79 | 1.05 | 1.04 | 1.12 | 1.06 | 1.50 |
| kynurenate | ME448239 | 0.69 | 1.03 | 0.93 | 0.99 | 1.15 | 1.17 | 1.32 | 1.63 |
| ceramide (d18:1/17:0, d17:1/18:0)* | ME448040 | 0.74 | 1.07 | 0.62 | 1.18 | 0.79 | 0.84 | 1.58 | 1.17 |
| leucylglycine | ME448253 | 0.88 | 1.06 | 0.44 | 1.32 | 0.84 | 0.75 | 1.18 | 1.25 |
| N-palmitoyl-sphinganine (d18:0/16:0) | ME448396 | 0.75 | 1.10 | 0.58 | 1.25 | 0.72 | 1.02 | 0.89 | 1.30 |
| O-acetylhomoserine | ME448405 | 1.10 | 1.33 | 0.83 | 0.75 | 0.83 | 0.94 | 1.20 | 0.87 |
| 7-ketocholesterol | ME447945 | 1.08 | 1.06 | 0.71 | 1.19 | 0.71 | 0.72 | 1.14 | 0.78 |
| leucylalanine | ME448251 | 1.03 | 0.97 | 0.71 | 1.18 | 0.84 | 0.81 | 1.37 | 0.98 |
| dimethylglycine | ME448096 | 1.37 | 0.90 | 0.90 | 1.01 | 0.92 | 0.74 | 1.29 | 0.88 |
| beta-sitosterol | ME448011 | 1.34 | 0.93 | 0.87 | 1.04 | 0.68 | 0.86 | 1.20 | 0.81 |
| campesterol | ME448025 | 1.20 | 1.01 | 0.79 | 1.07 | 0.57 | 0.88 | 1.39 | 0.82 |
| N-acetylcitrulline | ME448332 | 1.33 | 0.94 | 0.97 | 0.96 | 0.69 | 1.18 | 0.87 | 0.81 |
| stigmasterol | ME448529 | 1.31 | 0.98 | 0.87 | 1.09 | 0.64 | 0.88 | 0.82 | 0.64 |
| beta-guanidinopropanoate | ME448007 | 1.36 | 1.19 | 0.72 | 0.87 | 0.64 | 0.84 | 0.99 | 0.89 |
| ursodeoxycholate sulfate (2) | ME448584 | 1.46 | 0.99 | 0.96 | 0.83 | 0.45 | 0.89 | 1.17 | 0.90 |
| N-methylglutamate | ME448383 | 1.28 | 0.83 | 1.01 | 1.17 | 0.78 | 0.67 | 0.68 | 0.85 |
| sedoheptulose | ME448509 | 1.35 | 0.88 | 1.10 | 0.97 | 1.01 | 0.68 | 0.69 | 1.19 |
| alpha-tocotrienol | ME447973 | 1.19 | 1.20 | 1.01 | 0.89 | 0.37 | 0.67 | 0.66 | 0.94 |
| gamma-tocotrienol | ME448155 | 1.14 | 1.24 | 0.87 | 0.93 | 0.50 | 0.71 | 0.83 | 0.84 |
| pipecolate | ME448463 | 1.13 | 1.12 | 0.71 | 1.10 | 0.74 | 0.81 | 0.73 | 0.87 |
| cerotoylcarnitine (C26)* | ME448043 | 1.00 | 1.13 | 0.85 | 1.12 | 0.56 | 0.68 | 0.75 | 0.97 |
| maleate | ME448279 | 1.08 | 1.12 | 1.01 | 1.00 | 0.71 | 0.57 | 0.64 | 0.94 |
| thymine | ME448556 | 0.67 | 1.24 | 1.12 | 1.01 | 0.66 | 0.69 | 0.89 | 0.90 |
| palmitate (16:0) | ME448425 | 0.85 | 1.03 | 1.06 | 1.17 | 0.74 | 0.64 | 1.12 | 0.74 |
| cholesterol | ME448049 | 1.00 | 0.98 | 0.98 | 1.25 | 0.50 | 0.68 | 0.90 | 0.63 |
| oleate/vaccenate (18:1) | ME448410 | 0.81 | 1.02 | 1.01 | 1.26 | 0.66 | 0.73 | 0.85 | 0.65 |
| arachidoyl ethanolamide (20:0)* | ME447989 | 0.86 | 1.10 | 0.93 | 1.24 | 0.79 | 0.62 | 0.88 | 0.56 |
| glycosyl-N-palmitoyl-sphingosine (d18:1/16:0) | ME448184 | 0.90 | 1.01 | 1.02 | 1.25 | 0.76 | 0.69 | 0.89 | 0.56 |
| lignoceroylcarnitine (C24)* | ME448256 | 1.08 | 1.09 | 0.89 | 1.04 | 1.02 | 0.74 | 0.90 | 0.80 |
| behenoyl ethanolamide (22:0)* | ME448000 | 1.05 | 1.03 | 0.93 | 1.23 | 0.90 | 0.47 | 0.87 | 0.60 |
| lignoceroyl ethanolamide (24:0)* | ME448255 | 1.10 | 1.02 | 0.91 | 1.15 | 0.85 | 0.57 | 0.97 | 0.72 |
| 4-methyl-2-oxopentanoate | ME447909 | 0.73 | 0.90 | 1.15 | 1.45 | 0.44 | 0.81 | 1.01 | 0.76 |
| alpha-ketoglutarate | ME447969 | 1.02 | 0.76 | 1.19 | 1.23 | 0.48 | 0.92 | 1.18 | 0.76 |
| N-methylleucine | ME448385 | 0.97 | 0.74 | 1.17 | 1.31 | 0.35 | 0.75 | 1.09 | 0.86 |
| ferulate | ME448127 | 0.66 | 0.94 | 0.94 | 1.34 | 0.45 | 0.85 | 1.05 | 1.19 |
| N-acetylhistamine | ME448340 | 0.96 | 0.99 | 0.95 | 1.09 | 0.35 | 0.98 | 1.28 | 1.07 |
| N-palmitoylglycine | ME448394 | 0.92 | 1.00 | 0.94 | 1.19 | 0.77 | 1.19 | 1.20 | 0.45 |
| oleoylcarnitine (C18:1) | ME448412 | 0.75 | 1.24 | 0.78 | 1.19 | 0.63 | 1.11 | 1.01 | 0.79 |
| stearoylcarnitine (C18) | ME448527 | 0.87 | 1.01 | 0.68 | 1.26 | 0.38 | 1.24 | 1.07 | 0.95 |
| glycerophosphoglycerol | ME448172 | 0.87 | 0.94 | 1.00 | 1.02 | 1.25 | 1.06 | 0.70 | 1.44 |
| N-acetylglutamine | ME448338 | 0.82 | 1.07 | 0.83 | 0.96 | 1.14 | 1.46 | 0.89 | 1.30 |
| N-acetylhistidine | ME448341 | 0.99 | 0.98 | 1.00 | 0.94 | 1.21 | 1.26 | 0.71 | 1.17 |
| aspartate | ME447995 | 0.84 | 0.94 | 1.16 | 0.92 | 1.01 | 1.32 | 0.92 | 1.31 |
| palmitoylcarnitine (C16) | ME448432 | 0.83 | 0.88 | 1.14 | 1.02 | 1.08 | 1.39 | 0.68 | 1.20 |
| levulinate (4-oxovalerate) | ME448254 | 0.84 | 0.93 | 0.98 | 1.01 | 0.85 | 1.39 | 1.29 | 1.33 |
| riboflavin (Vitamin B2) | ME448494 | 1.00 | 1.08 | 0.82 | 0.90 | 0.90 | 1.25 | 1.03 | 1.31 |
| nicotinate | ME448378 | 1.03 | 0.95 | 0.87 | 0.99 | 1.14 | 1.22 | 1.08 | 1.18 |
| pantothenate | ME448439 | 1.05 | 0.99 | 0.86 | 0.94 | 1.06 | 1.14 | 1.15 | 1.32 |
| N6-methyladenosine | ME448322 | 0.59 | 1.09 | 0.87 | 1.02 | 1.13 | 1.29 | 1.34 | 1.15 |
| pyridoxamine | ME448482 | 0.91 | 1.04 | 0.82 | 0.92 | 1.40 | 1.42 | 1.15 | 1.11 |
| 10-hydroxystearate | ME447747 | 0.68 | 1.03 | 0.86 | 1.30 | 1.03 | 0.81 | 1.17 | 0.78 |
| benzoate | ME448002 | 0.76 | 0.97 | 0.79 | 1.22 | 1.07 | 1.05 | 0.91 | 1.04 |
| N-acetylmuramate | ME448346 | 0.92 | 1.04 | 1.03 | 1.00 | 1.40 | 0.82 | 0.94 | 0.95 |
| N-alpha-acetylornithine | ME448359 | 0.80 | 1.17 | 1.12 | 1.01 | 1.12 | 0.73 | 0.73 | 0.72 |
| cis-urocanate | ME448055 | 0.84 | 0.97 | 1.33 | 0.92 | 1.06 | 1.13 | 1.09 | 0.88 |
| 5-oxoproline | ME447941 | 0.79 | 1.06 | 1.37 | 0.92 | 1.04 | 0.76 | 1.11 | 0.88 |
| N-acetylglycine | ME448339 | 0.89 | 1.05 | 1.34 | 0.94 | 0.85 | 0.65 | 1.14 | 0.74 |
| fucose | ME448135 | 0.93 | 0.83 | 1.02 | 1.13 | 1.13 | 0.90 | 1.09 | 1.30 |
| N-acetylglucosamine/N-acetylgalactosamine | ME448335 | 0.86 | 0.84 | 1.25 | 1.11 | 1.06 | 0.79 | 1.02 | 1.11 |
| N-acetylasparagine | ME448327 | 0.92 | 0.97 | 1.16 | 0.95 | 0.97 | 1.02 | 1.23 | 1.06 |
| N-methylalanine | ME448381 | 0.99 | 1.05 | 1.02 | 0.99 | 0.92 | 0.90 | 1.22 | 0.85 |
| pseudouridine | ME448478 | 0.95 | 1.05 | 1.12 | 0.96 | 0.90 | 0.83 | 1.13 | 0.94 |
| 6-oxopiperidine-2-carboxylate | ME447944 | 0.99 | 1.13 | 1.00 | 0.84 | 1.14 | 0.88 | 1.15 | 1.07 |
| 2^-O-methyluridine | ME447838 | 0.76 | 1.13 | 0.93 | 0.97 | 1.02 | 0.94 | 1.15 | 1.11 |
| xanthine | ME448597 | 0.72 | 1.14 | 1.00 | 0.99 | 1.03 | 0.94 | 1.17 | 1.08 |
| hypoxanthine | ME448218 | 0.88 | 1.09 | 1.02 | 0.96 | 1.04 | 0.97 | 0.90 | 1.09 |
| N-acetylalanine | ME448325 | 0.79 | 1.11 | 1.06 | 0.99 | 0.86 | 0.85 | 1.01 | 1.16 |
| glycerophosphoinositol* | ME448173 | 0.95 | 0.53 | 1.00 | 1.42 | 1.17 | 0.97 | 1.14 | 1.22 |
| acisoga | ME447956 | 1.30 | 0.74 | 1.10 | 0.98 | 1.01 | 1.07 | 1.30 | 0.99 |
| mevalonolactone | ME448303 | 1.40 | 0.68 | 1.30 | 0.87 | 0.92 | 1.08 | 1.26 | 0.97 |
| cysteine | ME448062 | 0.99 | 0.78 | 1.50 | 0.82 | 0.38 | 1.22 | 0.74 | 1.82 |
| D-urobilin | ME448108 | 1.13 | 0.94 | 0.91 | 0.84 | 0.57 | 1.40 | 0.49 | 1.91 |
| malate | ME448278 | 1.07 | 0.86 | 0.99 | 0.94 | 0.35 | 1.36 | 0.81 | 1.82 |
| cytosine | ME448069 | 1.20 | 0.70 | 0.99 | 0.94 | 0.83 | 1.57 | 0.58 | 1.81 |
| gentisate | ME448157 | 1.36 | 0.77 | 1.17 | 0.60 | 0.87 | 1.51 | 0.78 | 1.82 |
| methyl glucopyranoside (alpha + beta) | ME448295 | 0.93 | 0.83 | 1.22 | 1.21 | 0.80 | 0.99 | 0.69 | 0.85 |
| nicotinamide riboside | ME448377 | 0.89 | 0.99 | 1.00 | 1.08 | 0.85 | 1.12 | 0.53 | 1.17 |
| glutamate | ME448162 | 0.92 | 0.96 | 1.11 | 0.97 | 0.54 | 1.31 | 0.75 | 1.29 |
| malonylcarnitine | ME448281 | 1.10 | 1.02 | 1.21 | 0.83 | 0.41 | 1.12 | 0.71 | 1.25 |
| pyridoxal | ME448481 | 1.16 | 0.93 | 1.02 | 0.87 | 0.69 | 1.23 | 0.65 | 1.56 |
| succinimide | ME448532 | 0.98 | 1.02 | 1.01 | 0.91 | 0.86 | 1.03 | 0.85 | 1.48 |
| bilirubin (E,Z or Z,E)* | ME448014 | 0.77 | 0.82 | 1.39 | 0.87 | 0.78 | 1.35 | 0.29 | 1.42 |
| beta-hydroxyisovalerate | ME448008 | 1.22 | 0.90 | 1.22 | 0.72 | 0.65 | 1.61 | 0.64 | 1.33 |
| deoxycarnitine | ME448075 | 1.16 | 0.77 | 1.19 | 0.90 | 1.07 | 1.56 | 0.63 | 1.15 |
| histamine | ME448208 | 1.19 | 0.90 | 1.26 | 1.01 | 0.23 | 1.02 | 1.16 | 0.60 |
| 3-(3-hydroxyphenyl)propionate | ME447845 | 1.38 | 1.03 | 0.85 | 0.89 | 0.04 | 1.26 | 0.96 | 0.73 |
| 3-hydroxysebacate | ME447875 | 1.35 | 1.00 | 0.96 | 1.01 | 0.10 | 0.96 | 0.80 | 0.57 |
| nervonoylcarnitine (C24:1)* | ME448370 | 1.19 | 0.94 | 1.27 | 1.01 | 0.17 | 1.31 | 0.52 | 0.68 |
| erucoylcarnitine (C22:1)* | ME448120 | 0.93 | 0.99 | 1.07 | 1.01 | 0.17 | 1.45 | 0.97 | 0.74 |
| 3,7-dimethylurate | ME447854 | 1.17 | 1.00 | 0.82 | 1.04 | 0.07 | 1.37 | 0.78 | 0.79 |
| arachidoylcarnitine (C20)* | ME447990 | 1.07 | 1.02 | 0.94 | 1.05 | 0.20 | 1.48 | 0.72 | 0.76 |
| phenylacetate | ME448445 | 1.09 | 1.20 | 0.67 | 0.83 | 0.49 | 1.64 | 1.12 | 0.92 |
| trans-urocanate | ME448560 | 1.01 | 1.11 | 0.81 | 0.90 | 0.71 | 1.38 | 1.14 | 1.09 |
| 4-imidazoleacetate | ME447908 | 1.20 | 1.03 | 0.67 | 0.94 | 0.40 | 1.58 | 0.56 | 1.31 |
| 5alpha-androstan-3beta,17beta-diol disulfate | ME447924 | 1.31 | 1.16 | 0.68 | 0.83 | 0.67 | 1.27 | 0.78 | 1.17 |
| N-carbamoylaspartate | ME448364 | 1.29 | 0.87 | 0.94 | 0.95 | 0.09 | 1.35 | 1.35 | 1.04 |
| cysteine s-sulfate | ME448063 | 0.90 | 0.93 | 1.14 | 0.89 | 0.44 | 1.34 | 1.31 | 1.48 |
| pyruvate | ME448487 | 1.09 | 0.81 | 1.40 | 0.89 | 0.29 | 1.47 | 0.92 | 1.05 |
| tetrahydrocortisone | ME448546 | 1.31 | 0.71 | 1.15 | 0.90 | 0.45 | 1.38 | 0.96 | 1.32 |
| allo-threonine | ME447965 | 1.88 | 0.96 | 0.69 | 0.98 | 0.92 | 0.41 | 0.57 | 1.28 |
| adenine | ME447957 | 2.11 | 0.79 | 0.68 | 0.82 | 1.14 | 1.19 | 0.67 | 0.68 |
| methylmalonate (MMA) | ME448297 | 2.00 | 0.82 | 0.91 | 0.83 | 0.11 | 1.32 | 0.66 | 0.93 |
| picolinate | ME448461 | 1.57 | 0.85 | 0.92 | 0.83 | NA | 1.41 | 0.70 | 1.14 |
| N2-acetyllysine | ME448316 | 1.73 | 0.82 | 0.67 | 0.80 | 0.86 | 1.66 | 0.62 | 1.28 |
| beta-alanine | ME448005 | 1.83 | 1.04 | 0.64 | 0.76 | 0.66 | 0.99 | 0.67 | 1.04 |
| 3-(2-hydroxyphenyl)propionate | ME447844 | 1.71 | 1.11 | 0.52 | 0.88 | 0.69 | 1.49 | 0.86 | 0.69 |
| sulfate* | ME448536 | 1.54 | 1.04 | 0.83 | 0.91 | 0.41 | 1.29 | 0.44 | 0.72 |
| 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) | ME447858 | 0.56 | 1.69 | 0.30 | 0.88 | 1.07 | 0.48 | NA | 1.35 |
| lactosyl-N-behenoyl-sphingosine (d18:1/22:0)* | ME448243 | 0.68 | 1.37 | 0.38 | 1.04 | 0.90 | 1.20 | 0.45 | 1.39 |
| N6-carboxyethyllysine | ME448319 | 0.65 | 1.44 | 0.64 | 1.09 | 1.38 | 0.98 | 0.57 | 1.17 |
| bilirubin (E,E)* | ME448013 | 0.86 | 1.03 | 0.66 | 1.12 | 0.85 | 1.76 | NA | 0.82 |
| heme | ME448196 | 1.20 | 1.01 | 0.66 | 1.08 | 0.19 | 1.63 | 0.15 | 0.98 |
| pregnen-diol disulfate C21H34O8S2* | ME448469 | 0.83 | 1.54 | 0.58 | 0.91 | 0.46 | 1.51 | 0.50 | 0.80 |
| pregn steroid monosulfate C21H34O5S* | ME448467 | 0.57 | 1.34 | 0.40 | 1.24 | 0.49 | 2.22 | 0.52 | 0.93 |
| androstenediol (3beta,17beta) monosulfate (1) | ME447978 | 0.54 | 1.50 | 0.27 | 1.42 | 0.11 | 1.92 | 0.18 | 1.17 |
| pregnenolone sulfate | ME448470 | 0.67 | 1.61 | 0.35 | 1.30 | 0.18 | 1.63 | 0.44 | 0.93 |
| 5alpha-androstan-3alpha,17alpha-diol monosulfate | ME447918 | 0.59 | 0.88 | 0.38 | 1.33 | 0.52 | 1.69 | 0.59 | 1.39 |
| 5alpha-androstan-3beta,17beta-diol monosulfate (2) | ME447926 | 0.57 | 0.94 | 0.41 | 1.28 | 0.72 | 1.73 | 0.48 | 1.04 |
| 5alpha-androstan-3alpha,17alpha-diol disulfate | ME447917 | 0.68 | 1.10 | 0.48 | 1.11 | 0.71 | 1.69 | 0.90 | 0.98 |
| androsterone sulfate | ME447980 | 0.98 | 1.06 | 0.30 | 1.29 | 0.85 | 1.68 | 0.93 | 1.08 |
| androstenediol (3beta,17beta) disulfate (2) | ME447977 | 0.78 | 0.99 | 0.46 | 1.13 | 0.45 | 1.79 | 0.58 | 1.87 |
| sphinganine | ME448521 | 0.63 | 1.08 | 0.50 | 1.18 | 0.48 | 1.63 | 0.60 | 1.87 |
| carboxyethyl-GABA | ME448030 | 0.72 | 0.99 | 0.76 | 1.18 | 0.68 | 1.41 | 0.71 | 1.41 |
| hexadecasphinganine (d16:0)* | ME448203 | 0.60 | 1.10 | 0.60 | 1.16 | 0.53 | 1.67 | 0.72 | 1.54 |
| dehydroisoandrosterone sulfate (DHEA-S) | ME448072 | 0.76 | 1.21 | 0.38 | 0.96 | 0.73 | 1.82 | 0.93 | 1.94 |
| sphingosine | ME448522 | 0.47 | 1.06 | 0.57 | 1.09 | 0.44 | 1.83 | 1.02 | 2.17 |
| hexadecasphingosine (d16:1)* | ME448204 | 0.33 | 0.79 | 1.07 | 1.30 | 0.43 | 1.55 | 0.76 | 1.40 |
| phytosphingosine | ME448460 | 0.81 | 0.79 | 1.01 | 1.03 | 0.65 | 2.04 | 1.11 | 1.30 |
| 7-methylguanine | ME447948 | 0.73 | 0.92 | 1.02 | 0.93 | 0.46 | 1.92 | 0.82 | 1.66 |
| sphingadienine | ME448520 | 0.50 | 0.86 | 0.90 | 1.19 | 0.17 | 2.01 | 0.68 | 1.62 |
| 3-hydroxyhexanoate | ME447866 | 0.73 | 1.24 | 0.49 | 0.83 | NA | 1.43 | 1.02 | 2.20 |
| orotidine | ME448421 | 0.70 | 0.79 | 0.46 | 1.53 | 0.12 | 1.56 | 0.45 | 1.93 |
| 3-ketosphinganine | ME447879 | 0.47 | 1.06 | 0.48 | 1.22 | 0.30 | 1.45 | 0.17 | 2.56 |
| heptadecasphingosine (d17:1) | ME448197 | 0.37 | 1.12 | 0.42 | 1.40 | 0.29 | 1.23 | 0.33 | 2.07 |
| ribose | ME448496 | 0.54 | 1.09 | 0.70 | 1.20 | 1.05 | 1.46 | 0.58 | 2.24 |
| 3-ureidopropionate | ME447890 | 1.16 | 1.15 | 0.59 | 0.89 | 0.60 | 1.14 | 0.10 | 2.04 |
| eicosanoylsphingosine (d20:1)* | ME448110 | 0.80 | 0.99 | 0.87 | 0.94 | 0.55 | 1.40 | 0.25 | 2.25 |
| pantetheine | ME448438 | 0.78 | 0.84 | 0.75 | 1.02 | 0.39 | 1.59 | 0.30 | 1.97 |
| harmane | ME448195 | 2.26 | 1.12 | 0.88 | 0.60 | NA | 0.91 | 1.55 | 0.75 |
| N-methyltryptophan | ME448390 | 2.17 | 0.89 | 0.40 | 0.79 | NA | NA | 1.24 | 0.54 |
| 3-hydroxy-2-ethylpropionate | ME447861 | 1.61 | 1.56 | NA | 0.79 | 0.87 | NA | 0.96 | 0.67 |
| pheophorbide A | ME448454 | 1.29 | 1.77 | 0.24 | 0.64 | 0.08 | 0.58 | 1.28 | 0.90 |
| 1-methylhistamine | ME447767 | 1.36 | 0.62 | 1.18 | NA | NA | NA | 0.50 | NA |
| phenylacetylglutamate | ME448446 | 2.14 | 0.82 | 1.58 | 0.70 | NA | NA | 0.94 | NA |
| 1-oleoyl-GPI (18:1)* | ME447777 | 1.83 | 0.41 | 0.83 | 1.01 | NA | 0.58 | NA | 0.44 |
| saccharopine | ME448501 | 2.22 | 0.50 | 1.22 | 0.93 | 0.22 | 0.35 | 0.15 | 0.76 |
| digalacturonic acid | ME448086 | 2.23 | 0.77 | 0.97 | 0.68 | NA | 0.50 | 0.09 | 1.10 |
| ethylmalonate | ME448124 | 1.82 | 0.80 | 1.16 | 0.83 | 0.05 | 0.81 | 0.25 | 1.03 |
| 1-methylnicotinamide | ME447769 | 1.91 | 0.69 | 1.53 | 0.78 | 0.52 | 0.77 | 0.30 | 0.49 |
| mannose | ME448288 | 1.69 | 0.82 | 1.28 | 0.96 | 0.62 | 0.70 | 0.96 | 0.62 |
| deoxymugineic acid | ME448078 | 1.67 | 1.26 | 1.21 | 0.71 | 0.63 | 0.48 | 0.51 | 0.48 |
| tyramine O-sulfate | ME448572 | 1.86 | 1.20 | 0.79 | 0.79 | 0.70 | 0.20 | 0.56 | 0.16 |
| dodecanedioate (C12-DC) | ME448105 | 2.26 | 1.11 | 0.82 | 0.58 | 0.24 | 0.67 | 0.34 | 0.74 |
| N-carbamoylsarcosine | ME448366 | 2.25 | 1.17 | 0.55 | 0.90 | 0.46 | 0.41 | 0.57 | 0.47 |
| 5alpha-pregnan-3beta,20alpha-diol disulfate | ME447928 | 1.42 | 1.62 | 1.25 | 0.62 | 0.09 | 0.31 | 0.10 | 0.22 |
| 5alpha-pregnan-3beta,20alpha-diol monosulfate (1) | ME447929 | 1.87 | 1.12 | 1.14 | 0.53 | NA | 0.18 | NA | 0.29 |
| escitalopram | ME448123 | 1.51 | 0.56 | 1.15 | 0.78 | NA | NA | NA | NA |
| nicotinic acid mononucleotide (NaMN) | ME448380 | 1.89 | 0.54 | 1.47 | 1.54 | 0.11 | 0.06 | NA | 0.11 |
| tiglylcarnitine (C5:1-DC) | ME448557 | 1.57 | 0.35 | 2.27 | 0.46 | NA | 0.10 | NA | 0.47 |
| 1,3,7-trimethylurate | ME447743 | 2.41 | 0.63 | 1.90 | 0.71 | 0.01 | 0.15 | 0.19 | 0.16 |
| skatol | ME448515 | 2.33 | 0.37 | 2.53 | 0.47 | NA | NA | NA | NA |
| caprylate (8:0) | ME448028 | 2.40 | 0.47 | 2.28 | 0.33 | NA | 0.78 | 0.58 | 0.25 |
| 3-methylurate* | ME447886 | 1.70 | 0.54 | 2.03 | 0.68 | NA | 1.10 | 0.48 | 0.30 |
| theobromine | ME448548 | 1.91 | 0.72 | 2.01 | 0.57 | 0.10 | 1.20 | 1.10 | 0.44 |
| N-glycolylneuraminate | ME448374 | 2.81 | 0.60 | 1.43 | 0.26 | 0.20 | 0.78 | 0.31 | 0.99 |
| N-methyltaurine | ME448389 | 2.63 | 1.11 | 1.72 | 0.49 | NA | 0.83 | NA | 0.77 |
| 4-hydroxyphenylacetate | ME447906 | 2.66 | 0.88 | 1.14 | 0.51 | 0.63 | 1.11 | 0.61 | 0.49 |
| indoleacetate | ME448225 | 2.47 | 0.61 | 1.61 | 0.50 | 0.43 | 0.59 | 0.79 | 0.61 |
| glycerophosphoserine* | ME448175 | 0.71 | 0.56 | 1.15 | 0.71 | 2.45 | 1.31 | 1.46 | 2.43 |
| tryptophan | ME448568 | 0.88 | 0.78 | 1.20 | 0.73 | 1.80 | 1.42 | 1.22 | 2.05 |
| erythronate* | ME448121 | 0.80 | 0.76 | 1.62 | 0.70 | 1.51 | 0.82 | 1.67 | 1.98 |
| myo-inositol | ME448305 | 1.03 | 0.65 | 1.53 | 0.62 | 1.74 | 0.70 | 0.91 | 2.40 |
| ribitol | ME448493 | 0.57 | 0.83 | 1.31 | 0.88 | 1.63 | 0.50 | 0.83 | 2.39 |
| glycerophosphorylcholine (GPC) | ME448174 | 1.56 | 0.64 | 1.28 | 0.77 | 1.71 | 0.44 | 0.86 | 1.96 |
| N6,N6,N6-trimethyllysine | ME448317 | 2.21 | 0.41 | 1.35 | 0.57 | 1.69 | 0.50 | 1.11 | 1.76 |
| lysylleucine | ME448277 | 1.50 | 0.59 | 0.51 | 1.24 | 1.95 | 0.66 | NA | 2.19 |
| 3-hydroxybutyrate (BHBA) | ME447863 | 0.99 | 0.54 | 0.42 | 1.48 | 2.39 | 1.09 | 1.08 | 1.76 |
| 2,4,6-trihydroxybenzoate | ME447803 | 1.57 | 0.87 | 0.85 | 0.77 | 2.48 | 0.84 | 0.82 | 1.50 |
| glycerophosphoethanolamine | ME448171 | 1.09 | 0.63 | 1.12 | 1.04 | 1.90 | 1.12 | 0.69 | 1.59 |
| imidazole propionate | ME448221 | 1.97 | 0.61 | 0.70 | 0.53 | 0.74 | 1.16 | 1.48 | 2.96 |
| diaminopimelate | ME448084 | 0.80 | 0.94 | 0.74 | 0.71 | 0.60 | 1.40 | 1.40 | 2.97 |
| proline | ME448472 | 0.76 | 0.86 | 0.95 | 0.75 | 1.15 | 1.26 | 1.64 | 2.79 |
| ectoine | ME448109 | 1.27 | 0.68 | 0.50 | 1.23 | 0.80 | 0.60 | 1.66 | 2.22 |
| N(^1)-acetylspermidine | ME448309 | 1.75 | 0.58 | 0.98 | 0.89 | 0.79 | 0.71 | 1.72 | 1.60 |
| N-acetylproline | ME448349 | 1.53 | 0.88 | 0.72 | 0.70 | 0.64 | 1.10 | 1.89 | 1.93 |
| gamma-glutamylmethionine | ME448151 | 1.55 | 0.65 | 0.78 | 0.72 | 1.22 | 1.19 | 0.92 | 2.29 |
| malonate | ME448280 | 1.39 | 0.91 | 0.85 | 0.86 | 1.26 | 1.20 | 0.45 | 1.42 |
| cysteinylglycine | ME448065 | 1.29 | 0.64 | 0.85 | 0.75 | 1.41 | 1.34 | 0.35 | 1.95 |
| trimethylamine N-oxide | ME448566 | 1.31 | 1.02 | 0.64 | 0.65 | 1.38 | 1.52 | 0.41 | 1.99 |
| 3-hydroxy-3-methylglutarate | ME447862 | 0.96 | 0.37 | 0.90 | 1.51 | 0.69 | 0.76 | 0.84 | 2.38 |
| ribulose/xylulose | ME448497 | 1.15 | 0.65 | 1.08 | 1.20 | 0.52 | 0.56 | 0.24 | 2.32 |
| arabinose | ME447984 | 1.15 | 0.54 | 1.20 | 1.27 | 0.93 | 0.48 | 0.75 | 1.78 |
| propionylglycine | ME448475 | 0.94 | 0.71 | 0.97 | 0.99 | 0.96 | 0.91 | 1.24 | 1.86 |
| trans-4-hydroxyproline | ME448216 | 1.13 | 0.62 | 1.01 | 1.08 | 0.72 | 1.15 | 1.24 | 1.88 |
| N-monomethylarginine | ME448391 | 0.66 | 0.58 | 0.84 | 0.93 | 2.34 | 2.19 | 1.07 | 1.25 |
| 1-oleoyl-GPG (18:1)* | ME447776 | 0.45 | 0.31 | 1.51 | 1.15 | 1.17 | 1.68 | 1.92 | 0.38 |
| dihomo-linolenate (20:3n3 or n6) | ME448089 | 0.74 | 1.40 | 0.52 | 1.02 | 1.07 | 1.43 | 1.38 | 0.43 |
| tyrosylglycine | ME448575 | 0.62 | 1.02 | 0.58 | 1.07 | 1.70 | 2.05 | 1.58 | 0.48 |
| 5alpha-androstan-3alpha,17beta-diol disulfate | ME447919 | 2.23 | 0.69 | 0.92 | 0.64 | 1.17 | 1.89 | 1.46 | 0.81 |
| 4-guanidinobutanoate | ME447898 | 1.43 | 0.58 | 1.10 | 0.85 | 1.50 | 1.54 | 1.73 | 1.08 |
| N-acetyltyrosine | ME448357 | 1.39 | 1.06 | 0.84 | 0.62 | 1.20 | 1.77 | 1.41 | 0.82 |
| serine | ME448510 | 0.82 | 0.91 | 1.28 | 0.84 | 1.25 | 1.28 | 1.54 | 1.25 |
| threonine | ME448553 | 0.81 | 0.91 | 1.43 | 0.78 | 1.03 | 1.14 | 1.44 | 1.39 |
| glycerate | ME448168 | 0.84 | 0.75 | 1.39 | 0.89 | 1.08 | 1.28 | 1.82 | 1.29 |
| glycine | ME448176 | 0.70 | 0.80 | 1.47 | 0.89 | 1.38 | 1.13 | 1.70 | 1.29 |
| thymidine | ME448555 | 0.87 | 1.04 | 1.18 | 0.68 | 1.08 | 1.44 | 1.15 | 1.58 |
| cysteine sulfinic acid | ME448064 | 1.01 | 0.81 | 1.10 | 0.83 | 1.19 | 1.23 | 1.42 | 1.54 |
| isoleucine | ME448233 | 0.87 | 1.01 | 0.94 | 0.86 | 1.39 | 1.23 | 1.44 | 1.37 |
| 2^-deoxyinosine | ME447818 | 0.82 | 0.87 | 1.35 | 0.64 | 0.86 | 1.93 | 1.47 | 1.69 |
| 2-methylserine | ME447836 | 0.56 | 0.80 | 1.53 | 0.73 | 0.99 | 1.52 | 1.56 | 1.68 |
| 2^-deoxyuridine | ME447819 | 0.63 | 1.07 | 1.09 | 0.66 | 1.24 | 1.67 | 1.89 | 1.69 |
| 3-hydroxylaurate | ME447869 | 0.86 | 0.73 | 1.22 | 0.76 | 1.24 | 1.76 | 2.00 | 1.71 |
| 5-methylthioadenosine (MTA) | ME447939 | 0.89 | 0.67 | 0.97 | 0.89 | 1.27 | 1.68 | 1.27 | 1.49 |
| 3-hydroxydecanoate | ME447865 | 0.86 | 0.81 | 1.00 | 0.89 | 1.21 | 1.66 | 1.70 | 1.38 |
| glycylvaline | ME448189 | 0.79 | 0.98 | 0.75 | 0.92 | 0.98 | 1.76 | 1.67 | 1.48 |
| dimethylarginine (SDMA + ADMA) | ME448095 | 0.90 | 0.63 | 1.05 | 0.84 | 2.10 | 1.28 | 1.78 | 2.05 |
| valine | ME448588 | 0.71 | 1.03 | 0.93 | 0.72 | 2.11 | 1.11 | 2.06 | 1.87 |
| alanine | ME447962 | 0.78 | 0.94 | 0.94 | 0.81 | 1.91 | 1.26 | 1.85 | 1.67 |
| phenylalanine | ME448449 | 0.76 | 0.94 | 0.99 | 0.83 | 1.84 | 1.30 | 1.87 | 1.49 |
| glutamine | ME448164 | 0.81 | 0.86 | 1.17 | 0.79 | 1.72 | 1.33 | 2.27 | 1.31 |
| choline | ME448050 | 0.99 | 0.69 | 1.04 | 0.97 | 2.30 | 1.16 | 2.22 | 1.05 |
| dihomo-linolenoylcarnitine (20:3n3 or 6)* | ME448090 | 0.78 | 1.02 | 0.82 | 0.94 | 2.17 | 1.17 | 2.38 | 1.49 |
| 1-palmitoyl-GPE (16:0) | ME447788 | 0.81 | 0.92 | 0.80 | 1.10 | 1.75 | 1.22 | 1.47 | 1.02 |
| glycylleucine | ME448188 | 0.92 | 0.88 | 0.63 | 1.10 | 1.58 | 1.36 | 1.74 | 1.22 |
| leucine | ME448250 | 0.81 | 1.02 | 0.90 | 0.82 | 1.72 | 1.34 | 1.62 | 1.41 |
| citrulline | ME448057 | 0.75 | 1.07 | 0.74 | 0.94 | 1.48 | 1.39 | 1.62 | 1.31 |
| methionine | ME448292 | 0.80 | 0.99 | 0.87 | 0.85 | 1.51 | 1.49 | 1.82 | 1.41 |
| ceramide (d16:1/24:1, d18:1/22:1)* | ME448038 | 0.76 | 0.75 | 0.57 | 1.12 | 1.50 | 1.20 | 1.76 | 1.80 |
| tyrosine | ME448573 | 0.74 | 0.96 | 1.01 | 0.85 | 1.74 | 1.32 | 1.35 | 1.63 |
| vanillate | ME448595 | 0.61 | 0.87 | 0.78 | 0.98 | 1.64 | 1.11 | 1.25 | 1.77 |
| butyrylglutamine/isobutyrylglutamine | ME448019 | 0.89 | 0.90 | 0.61 | 1.01 | 1.39 | 1.34 | 1.29 | 1.80 |
| lysine | ME448276 | 0.83 | 0.92 | 0.86 | 0.80 | 1.61 | 1.53 | 1.51 | 1.93 |
| gamma-glutamyl-alpha-lysine | ME448143 | 0.72 | 0.82 | 0.74 | 1.03 | 2.37 | 1.46 | 1.40 | 1.68 |
| glutaminylleucine | ME448165 | 0.80 | 0.97 | 0.66 | 1.05 | 1.98 | 1.55 | 1.07 | 1.19 |
| threonylphenylalanine | ME448554 | 0.85 | 0.96 | 0.43 | 1.01 | 1.77 | 1.68 | 2.37 | 1.19 |
| isovalerate (i5:0) | ME448236 | 1.19 | 1.11 | 0.65 | 0.62 | 1.05 | 2.05 | 1.98 | 1.03 |
| phenylalanylglycine | ME448451 | 0.74 | 0.97 | 0.64 | 1.02 | 1.23 | 2.03 | 1.89 | 0.96 |
| valylglycine | ME448592 | 0.70 | 1.05 | 0.57 | 1.02 | 1.22 | 1.84 | 2.30 | 0.90 |
| gamma-glutamylleucine | ME448150 | 0.88 | 0.95 | 0.87 | 0.89 | 1.27 | 1.49 | 2.86 | 1.33 |
| N-behenoyl-sphingadienine (d18:2/22:0)* | ME448362 | 1.05 | 0.66 | 1.02 | 0.99 | 1.24 | 0.85 | 2.74 | 1.32 |
| N-formylphenylalanine | ME448373 | 0.87 | 1.03 | 0.92 | 0.88 | 1.37 | 0.87 | 2.67 | 1.04 |
| valerylglycine | ME448586 | 0.82 | 1.06 | 0.88 | 0.86 | 1.26 | 0.89 | 3.03 | 1.04 |
| 5-methyluridine (ribothymidine) | ME447940 | 0.68 | 1.13 | 1.19 | 0.75 | 0.90 | 1.19 | 2.06 | 0.93 |
| 4-ureidobutyrate | ME447913 | 0.81 | 1.22 | 0.83 | 0.85 | 0.77 | 1.02 | 2.44 | 0.96 |
| lithocholate | ME448272 | 0.66 | 1.17 | 0.80 | 1.00 | 1.39 | 0.80 | 2.31 | 0.87 |
| isobutyrylglycine | ME448231 | 0.92 | 1.05 | 0.83 | 0.94 | 1.11 | 0.88 | 2.33 | 0.95 |
| vanillin | ME448596 | 0.81 | 0.94 | 1.09 | 0.86 | 1.12 | 0.88 | 2.35 | 0.69 |
| glycylisoleucine | ME448187 | 0.90 | 0.98 | 0.72 | 1.05 | 1.07 | 1.31 | 1.75 | 1.08 |
| N-acetyl-beta-glucosaminylamine | ME448330 | 0.76 | 1.09 | 0.72 | 0.99 | 0.96 | 1.49 | 1.73 | 1.08 |
| 2-acetamidobutanoate | ME447809 | 0.97 | 1.06 | 0.74 | 0.88 | 1.06 | 1.18 | 1.65 | 1.40 |
| valerate (5:0) | ME448585 | 1.06 | 1.02 | 0.77 | 0.81 | 1.09 | 1.44 | 1.64 | 1.36 |
| isovalerylglycine | ME448237 | 0.97 | 1.08 | 0.95 | 0.96 | 0.99 | 0.75 | 1.73 | 0.89 |
| indole-3-carboxylic acid | ME448224 | 0.97 | 1.09 | 1.02 | 0.89 | 0.76 | 0.99 | 1.81 | 1.11 |
| S-1-pyrroline-5-carboxylate | ME448499 | 1.02 | 0.98 | 0.85 | 0.86 | 0.80 | 1.17 | 1.70 | 1.28 |
| 3-phenylpropionate (hydrocinnamate) | ME447888 | 0.84 | 1.02 | 0.69 | 0.96 | 1.18 | 1.15 | 2.17 | 1.56 |
| methionine sulfoxide | ME448294 | 0.82 | 1.09 | 0.65 | 1.00 | 1.14 | 1.07 | 1.99 | 1.32 |
| N-palmitoyl-sphingosine (d18:1/16:0) | ME448397 | 0.78 | 0.98 | 0.67 | 1.12 | 1.09 | 0.93 | 2.36 | 1.31 |
| tryptophylglycine | ME448570 | 0.73 | 1.03 | 0.63 | 1.09 | 1.08 | 1.08 | 2.24 | 1.04 |
| isoleucylglycine | ME448234 | 0.73 | 1.08 | 0.60 | 1.00 | 1.01 | 1.46 | 2.44 | 1.12 |
| valylleucine | ME448593 | 0.85 | 0.87 | 0.57 | 1.09 | 0.90 | 1.62 | 2.07 | 1.44 |
| N-methylphenylalanine | ME448386 | 0.45 | 1.19 | 1.21 | 1.02 | 1.33 | 0.27 | 2.24 | 0.41 |
| 3beta-hydroxy-5-cholestenoate | ME447856 | 0.40 | 1.44 | 0.36 | 1.48 | 1.75 | 0.52 | 1.86 | 0.26 |
| histidylalanine | ME448210 | 0.60 | 1.14 | 0.57 | 1.16 | 1.80 | 1.01 | 2.09 | 0.32 |
| N-acetylmethionine | ME448344 | 1.30 | 0.87 | 0.75 | 0.74 | 2.30 | 0.96 | 1.67 | 1.70 |
| N-acetyltryptophan | ME448356 | 1.33 | 0.78 | 0.79 | 0.79 | 2.52 | 1.37 | 1.85 | 1.08 |
| N-carbamoylalanine | ME448363 | 1.15 | 1.07 | 0.73 | 1.00 | 2.20 | 0.81 | 2.53 | 0.39 |
| leucylglutamine* | ME448252 | 0.66 | 0.89 | 0.64 | 1.14 | 2.79 | 1.30 | 1.87 | 0.90 |
| N6-acetyllysine | ME448318 | 0.94 | 0.98 | 0.84 | 0.79 | 2.70 | 1.03 | 2.46 | 0.97 |
| deoxycholate | ME448076 | 0.67 | 1.06 | 0.78 | 1.00 | 2.66 | 1.07 | 2.69 | 1.23 |
| linolenoylcarnitine (C18:3)* | ME448260 | 0.73 | 0.94 | 0.92 | 1.01 | 2.43 | 1.15 | 2.84 | 1.11 |
| 4-hydroxybenzoate | ME447899 | 0.89 | 0.87 | 1.83 | 0.77 | 1.96 | 0.47 | 1.37 | 0.95 |
| gamma-glutamylglutamine | ME448146 | 0.59 | 0.51 | 1.60 | 0.77 | 2.33 | 0.94 | 1.20 | 1.29 |
| 1-palmitoyl-GPC (16:0) | ME447787 | 0.97 | 0.72 | 1.57 | 0.85 | 2.90 | 0.45 | 1.70 | 0.82 |
| mevalonate | ME448301 | 1.45 | 0.55 | 1.36 | 0.82 | 2.30 | 0.81 | 1.44 | 1.01 |
| PAHSA (16:0/OH-18:0) | ME448424 | 0.89 | 0.87 | 0.43 | 1.46 | 1.48 | 0.17 | 1.13 | 0.96 |
| gamma-CEHC | ME448141 | 1.36 | 0.75 | 0.88 | 0.89 | 1.58 | 0.81 | 1.85 | 1.23 |
| pyrraline | ME448486 | 0.83 | 0.86 | 1.24 | 0.99 | 1.90 | 0.75 | 1.84 | 0.85 |
| N-acetylarginine | ME448326 | 0.93 | 1.05 | 1.12 | 0.82 | 1.70 | 0.89 | 1.82 | 0.84 |
| uracil | ME448577 | 0.78 | 1.09 | 0.97 | 0.96 | 1.52 | 0.89 | 1.76 | 0.90 |
| 9,10-DiHOME | ME447953 | 0.69 | 1.03 | 0.48 | 1.27 | 1.63 | 1.00 | 1.08 | 0.89 |
| 12,13-DiHOME | ME447749 | 0.86 | 0.96 | 0.47 | 1.34 | 1.71 | 0.63 | 1.45 | 1.03 |
| alanylleucine | ME447963 | 1.07 | 0.94 | 0.55 | 1.20 | 2.05 | 0.62 | 1.21 | 1.08 |
| 8-hydroxyoctanoate | ME447952 | 0.87 | 0.94 | 0.93 | 1.06 | 2.04 | 0.72 | 0.88 | 1.11 |
| methylphosphate | ME448298 | 0.90 | 0.87 | 0.87 | 1.15 | 1.73 | 0.75 | 1.30 | 1.17 |
| palmitoyl dihydrosphingomyelin (d18:0/16:0)* | ME448429 | 0.91 | 0.73 | 1.03 | 1.23 | 1.84 | 0.84 | 1.36 | 0.81 |
| phenylpyruvate | ME448453 | 0.71 | 0.75 | 1.22 | 1.34 | 2.29 | 0.71 | 1.70 | 0.67 |
| 2-hydroxyphenylacetate | ME447830 | 0.82 | 1.02 | 0.89 | 0.99 | 2.26 | 0.60 | 1.48 | 0.72 |
| alpha-methylornithine | ME447970 | 0.71 | 1.16 | 0.75 | 0.98 | 2.32 | 0.76 | 1.52 | 0.90 |
| formiminoglutamate | ME448132 | 0.86 | 1.14 | 0.81 | 0.92 | 2.44 | 0.81 | 1.55 | 1.10 |
| erucate (22:1n9) | ME448119 | 0.49 | 1.02 | 0.37 | 1.44 | 0.39 | 2.41 | 1.80 | 0.25 |
| solanidine | ME448518 | 0.74 | 1.32 | 0.73 | 0.79 | 0.25 | 2.42 | 1.07 | 0.48 |
| chenodeoxycholate | ME448045 | 0.40 | NA | 0.20 | 0.70 | 1.02 | 2.23 | 1.62 | 1.99 |
| gamma-glutamyl-epsilon-lysine | ME448144 | 0.66 | 0.90 | 1.10 | 0.82 | 0.91 | 2.01 | 1.06 | 1.86 |
| N6-carboxymethyllysine | ME448320 | 1.06 | 0.88 | 0.91 | 0.66 | 1.01 | 2.10 | 1.16 | 1.94 |
| N-formylmethionine | ME448372 | 0.92 | 0.89 | 0.63 | 0.77 | 1.37 | 1.91 | 2.10 | 1.99 |
| taurine | ME448539 | 1.09 | 0.87 | 0.42 | 0.91 | 1.25 | 2.16 | 1.44 | 1.73 |
| guanosine | ME448193 | 0.75 | 0.76 | 1.07 | 0.45 | 0.52 | 3.49 | 2.14 | 1.70 |
| 2^-deoxyguanosine | ME447817 | 0.72 | 0.72 | 1.25 | 0.48 | 0.88 | 2.85 | 2.00 | 2.37 |
| uridine | ME448579 | 0.63 | 0.94 | 0.93 | 0.60 | 1.02 | 2.57 | 2.13 | 2.02 |
| adenosine | ME447958 | 0.76 | 0.89 | 0.99 | 0.63 | 1.01 | 3.08 | 1.70 | 1.32 |
| cytidine | ME448067 | 1.00 | 0.58 | 1.57 | 0.51 | 0.41 | 2.93 | 1.65 | 1.73 |
| 3-hydroxyisobutyrate | ME447868 | 0.84 | 0.73 | 0.98 | 0.55 | 0.59 | 2.75 | 1.33 | 1.77 |
| guanine | ME448192 | 0.84 | 0.79 | 1.20 | 0.71 | 0.78 | 2.39 | 1.81 | 1.48 |
| inosine | ME448230 | 0.92 | 0.83 | 1.21 | 0.59 | 0.71 | 2.38 | 1.87 | 1.63 |
| N-acetyl-cadaverine | ME448331 | 2.61 | 0.42 | 1.24 | 0.45 | 0.32 | 1.02 | 2.31 | 1.14 |
| 1-stearoyl-GPI (18:0) | ME447797 | 2.03 | 0.59 | 0.93 | 0.62 | 0.50 | 1.79 | 2.52 | 1.66 |
| 7-methylurate | ME447949 | 1.75 | 0.54 | 1.12 | 0.41 | NA | 1.58 | 1.98 | 1.78 |
| 3-methylxanthine | ME447887 | 1.65 | 0.66 | 1.63 | 0.69 | NA | 0.92 | 1.78 | 0.44 |
| caprate (10:0) | ME448026 | 1.43 | 0.59 | 1.82 | 0.59 | 0.36 | 1.42 | 1.88 | 0.99 |
| N1-methyladenosine | ME447764 | 1.13 | 0.61 | 1.66 | 0.73 | 0.12 | 1.28 | 1.99 | 1.06 |
| asparagine | ME447994 | 0.95 | 0.84 | 1.49 | 0.48 | 0.49 | 1.91 | 2.55 | 1.53 |
| 5-dodecenoate (12:1n7) | ME447934 | 0.36 | 0.76 | 1.46 | 0.91 | 0.57 | 1.70 | 2.53 | 1.37 |
| myristoleate (14:1n5) | ME448307 | 0.37 | 0.78 | 1.40 | 1.01 | 0.45 | 1.35 | 2.60 | 1.63 |
| 2-hydroxyglutarate | ME447825 | 0.97 | 0.77 | 1.22 | 1.01 | 0.01 | 1.59 | 2.11 | 1.50 |
| 3-hydroxyphenylacetate | ME447872 | 0.69 | 1.04 | 0.78 | 0.77 | NA | 2.15 | 2.12 | 1.34 |
| N-palmitoylserine | ME448395 | 0.86 | 0.96 | 0.75 | 1.07 | 0.19 | 1.84 | 2.28 | 0.78 |
| tridecanedioate (C13-DC) | ME448564 | 0.78 | 1.31 | 0.76 | NA | NA | NA | NA | 0.84 |
| sertraline | ME448512 | 0.56 | 1.38 | 2.34 | 0.47 | NA | NA | NA | NA |
| stearidonate (18:4n3) | ME448525 | 0.05 | 1.57 | 2.50 | 0.71 | NA | 0.03 | NA | 0.11 |
| 5alpha-pregnan-3(alpha or beta),20beta-diol disulfate | ME447927 | 0.20 | 2.08 | 1.56 | 0.53 | 0.01 | 0.16 | 0.02 | 0.09 |
| caffeic acid sulfate | ME448023 | 0.13 | 1.57 | 1.26 | 1.05 | NA | NA | NA | 0.11 |
| 4-hydroxychlorothalonil | ME447901 | NA | 0.92 | NA | 1.11 | 1.28 | NA | 0.65 | NA |
| 2-hydroxyhippurate (salicylurate) | ME447826 | 0.53 | 0.38 | 0.16 | 1.99 | 0.92 | NA | 0.45 | 0.07 |
| biochanin A | ME448016 | 1.11 | NA | 0.12 | 1.32 | 0.57 | NA | 1.13 | NA |
| 3-hydroxyhippurate | ME447867 | 1.59 | 0.05 | 1.20 | 2.26 | 0.04 | 0.03 | NA | NA |
| phenylacetylglutamine | ME448447 | 1.45 | 0.08 | 0.73 | 2.16 | NA | 0.20 | 0.02 | 0.91 |
| (R)-salsolinol | ME447731 | 0.37 | 0.33 | 0.94 | 2.14 | NA | 1.36 | 0.15 | 0.51 |
| 4-methylcatechol sulfate | ME447910 | 0.36 | 0.85 | 0.53 | 1.83 | NA | 1.04 | NA | 0.83 |
| N2,N5-diacetylornithine | ME448315 | 0.70 | 0.63 | 0.77 | 1.78 | 0.29 | 1.12 | 0.37 | 0.67 |
| ergosterol | ME448117 | 0.47 | 0.92 | 0.47 | 1.92 | 0.58 | 0.35 | 0.18 | 1.09 |
| diglycerol | ME448087 | 0.63 | 1.07 | 0.50 | 1.71 | 0.40 | 0.64 | 0.51 | 0.60 |
| LAHSA (18:2/OH-18:0)* | ME448246 | 0.48 | 1.04 | 0.41 | 1.85 | 0.62 | 0.33 | 0.48 | 0.77 |
| OAHSA (18:1/OH-18:0) | ME448406 | 0.56 | 1.00 | 0.56 | 1.70 | 0.54 | 0.33 | 0.71 | 0.75 |
| m-tyramine | ME448304 | 0.43 | 0.58 | 0.65 | 2.12 | 0.08 | 0.13 | 0.17 | 0.19 |
| deoxycholic acid sulfate | ME448077 | 0.52 | 0.93 | 0.37 | 2.01 | NA | 0.52 | 0.00 | 0.38 |
| N-acetylserotonin | ME448352 | 0.53 | 1.00 | 0.74 | 1.75 | NA | 0.75 | NA | 0.24 |
| bufotenine | ME448018 | NA | 0.38 | NA | 2.46 | NA | 0.17 | NA | 0.89 |
| 1-linolenoyl-2-hexadecatrienoyl-galactosylglycerol (18:3/16:3) | ME447756 | 0.27 | 0.32 | NA | 2.41 | NA | 0.02 | 0.19 | 0.03 |
| hexanoylglycine | ME448206 | 0.46 | NA | 0.30 | 2.11 | NA | NA | 0.73 | NA |
| hippurate | ME448207 | 0.90 | 0.05 | 0.20 | 3.04 | 0.18 | 0.01 | 0.01 | 0.01 |
| N-acetylsphingosine | ME448353 | 0.29 | 0.38 | 0.22 | 3.12 | NA | 0.26 | 0.38 | 0.22 |
| lisinopril | ME448271 | 0.00 | 1.83 | 0.00 | 3.17 | NA | NA | NA | NA |
| 1,2,3-benzenetriol sulfate (1) | ME447735 | 0.05 | 1.93 | 0.02 | 2.21 | NA | 0.06 | 0.51 | NA |
| maltitol/lactitol/cellobiotol/palatinol | ME448282 | 0.03 | 2.03 | 0.13 | 2.19 | NA | NA | NA | 0.09 |
| saccharin | ME448500 | 0.29 | 1.93 | 0.08 | 1.87 | 0.06 | 0.08 | 0.15 | 0.02 |
| 5alpha-pregnan-3beta,20beta-diol monosulfate (1) | ME447931 | 0.23 | 1.97 | 0.38 | 1.50 | 0.05 | 0.58 | 0.08 | 0.31 |
| enterodiol | ME448113 | 0.25 | 1.76 | 0.41 | 1.43 | 0.31 | 0.38 | 0.49 | 0.13 |
| adenosine-2^,3^-cyclic monophosphate | ME447959 | NA | 1.74 | 0.06 | 1.40 | NA | NA | NA | 0.05 |
| hydrochlorothiazide | ME448214 | 0.10 | 1.35 | 0.58 | 1.62 | NA | NA | NA | NA |
| sucralose | ME448534 | 0.17 | 1.67 | 0.37 | 1.72 | 0.01 | 0.24 | 0.04 | 0.19 |
| 5alpha-pregnan-3beta-ol,20-one sulfate | ME447932 | 0.77 | 1.96 | 0.74 | 0.59 | NA | 0.82 | NA | 0.83 |
| pregnanolone/allopregnanolone sulfate | ME448468 | 0.33 | 2.26 | 0.34 | 0.81 | NA | 0.36 | NA | 0.43 |
| steviol | ME448528 | 0.44 | 1.84 | 0.14 | 0.94 | 0.09 | 0.64 | NA | 0.81 |
| 5alpha-pregnan-3beta,20alpha-diol monosulfate (2) | ME447930 | 0.81 | 2.09 | 0.56 | 1.17 | NA | 0.16 | NA | 0.11 |
| homovanillate sulfate | ME448212 | 0.29 | 2.02 | 0.83 | 0.79 | 0.63 | 0.27 | NA | 0.13 |
| ciliatine (2-aminoethylphosphonate) | ME448052 | 0.85 | 0.56 | 0.91 | 0.93 | 0.43 | 7.83 | 0.30 | NA |
| diphenhydramine | ME448100 | 1.60 | 0.71 | 0.56 | 0.42 | 0.03 | 9.14 | NA | 0.17 |
| ursocholate | ME448581 | 0.43 | 0.42 | 0.13 | 0.27 | 0.26 | 7.49 | 1.38 | 4.18 |
| indolelactate | ME448227 | 0.78 | 0.34 | 0.36 | 0.45 | 2.67 | 3.45 | 0.46 | 5.04 |
| (15:2)-anacardic acid | ME447730 | 0.08 | 0.17 | 1.78 | 0.33 | NA | 5.05 | NA | 7.47 |
| maltotriose | ME448286 | 0.17 | 0.17 | 1.18 | 0.13 | 0.04 | 4.40 | NA | 5.88 |
| 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6) | ME447778 | 0.19 | 0.27 | 0.84 | 0.19 | 11.16 | 0.14 | 7.66 | 0.05 |
| lactate | ME448241 | 0.33 | 0.36 | 1.31 | 0.43 | 13.51 | 0.80 | 0.60 | 1.49 |
Factors:
| F1 | Gender:Female | Timepoint:Baseline | CBT_Responder:No |
| F2 | Gender:Female | Timepoint:Baseline | CBT_Responder:Yes |
| F3 | Gender:Female | Timepoint:Post_CBT | CBT_Responder:No |
| F4 | Gender:Female | Timepoint:Post_CBT | CBT_Responder:Yes |
| F5 | Gender:Male | Timepoint:Baseline | CBT_Responder:No |
| F6 | Gender:Male | Timepoint:Baseline | CBT_Responder:Yes |
| F7 | Gender:Male | Timepoint:Post_CBT | CBT_Responder:No |
| F8 | Gender:Male | Timepoint:Post_CBT | CBT_Responder:Yes |