Auxiliary Material: biological_serum_28

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine34.814.6
HMDB00008 2-Hydroxybutyrate19.223.3
HMDB00042 Acetic acid25.731.9
HMDB00043 Betaine19.619.4
HMDB00060 Acetoacetate0.02.4
HMDB00062 L-Carnitine19.013.5
HMDB00064 Creatine4.314.5
HMDB00094 Citric acid78.663.6
HMDB00097 Choline2.44.0
HMDB00108 Ethanol12.813.4
HMDB00122 D-Glucose3086.93472.9
HMDB00123 Glycine123.1149.8
HMDB00131 Glycerol68.697.4
HMDB00142 Formic acid10.90.0
HMDB00148 L-Glutamic acid39.557.8
HMDB00157 Hypoxanthine13.210.8
HMDB00158 L-Tyrosine34.338.4
HMDB00159 L-Phenylalanine32.135.5
HMDB00161 L-Alanine275.5267.5
HMDB00162 L-Proline69.571.5
HMDB00167 L-Threonine116.297.4
HMDB00168 L-Asparagine2.60.0
HMDB00172 L-Isoleucine28.343.5
HMDB00177 L-Histidine32.047.4
HMDB00182 Lysine73.555.8
HMDB00187 L-Serine119.3101.4
HMDB00190 L-Lactic acid727.2829.0
HMDB00191 L-Aspartic acid27.70.0
HMDB00214 Ornithine0.618.2
HMDB00243 Pyruvic acid42.743.5
HMDB00254 Succinic acid0.52.8
HMDB00357 3-Hydroxybutyric acid52.556.9
HMDB00517 L-Arginine48.753.4
HMDB00562 Creatinine48.750.4
HMDB00641 L-Glutamine260.2280.0
HMDB00687 L-Leucine62.168.4
HMDB00691 Malonic acid4.84.7
HMDB00696 L-Methionine19.420.9
HMDB00863 Isopropanol4.95.5
HMDB00883 L-Valine115.3135.6
HMDB00929 L-Tryptophan10.10.0
HMDB01659 Acetone18.818.0
HMDB01873 Isobutyric acid5.06.5
HMDB01875 Methanol65.965.9
HMDB01881 Propylene glycol3.410.1
HMDB04983 Dimethylsulfone1.32.1