Auxiliary Material: biological_serum_1

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine63.025.5
HMDB00008 2-Hydroxybutyrate19.625.9
HMDB00042 Acetic acid42.849.3
HMDB00043 Betaine22.723.8
HMDB00060 Acetoacetate0.02.0
HMDB00062 L-Carnitine23.818.6
HMDB00064 Creatine20.831.8
HMDB00094 Citric acid98.694.4
HMDB00097 Choline8.711.0
HMDB00108 Ethanol74.886.5
HMDB00122 D-Glucose4684.94934.0
HMDB00123 Glycine149.0170.9
HMDB00131 Glycerol29.466.8
HMDB00142 Formic acid11.49.9
HMDB00148 L-Glutamic acid101.9113.5
HMDB00157 Hypoxanthine18.212.9
HMDB00158 L-Tyrosine48.044.2
HMDB00159 L-Phenylalanine49.649.3
HMDB00161 L-Alanine391.2384.4
HMDB00162 L-Proline106.2137.5
HMDB00167 L-Threonine139.3120.4
HMDB00168 L-Asparagine26.20.0
HMDB00172 L-Isoleucine34.549.9
HMDB00177 L-Histidine18.138.2
HMDB00182 Lysine85.993.2
HMDB00187 L-Serine238.7105.0
HMDB00190 L-Lactic acid1750.51914.4
HMDB00191 L-Aspartic acid47.132.6
HMDB00214 Ornithine0.026.2
HMDB00243 Pyruvic acid69.868.0
HMDB00254 Succinic acid3.54.5
HMDB00357 3-Hydroxybutyric acid23.926.5
HMDB00517 L-Arginine67.6104.0
HMDB00562 Creatinine41.543.3
HMDB00641 L-Glutamine224.3244.8
HMDB00687 L-Leucine85.083.1
HMDB00691 Malonic acid10.69.1
HMDB00696 L-Methionine15.619.6
HMDB00863 Isopropanol17.718.1
HMDB00883 L-Valine123.8137.5
HMDB00929 L-Tryptophan12.90.0
HMDB01659 Acetone9.610.6
HMDB01873 Isobutyric acid5.88.4
HMDB01875 Methanol80.980.8
HMDB01881 Propylene glycol0.08.7
HMDB04983 Dimethylsulfone1.44.6