Auxiliary Material: biological_serum_36

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine16.020.9
HMDB00008 2-Hydroxybutyrate14.218.2
HMDB00042 Acetic acid34.838.1
HMDB00043 Betaine19.824.2
HMDB00060 Acetoacetate3.31.7
HMDB00062 L-Carnitine23.122.3
HMDB00064 Creatine11.818.9
HMDB00094 Citric acid85.783.8
HMDB00097 Choline8.59.5
HMDB00108 Ethanol14.88.2
HMDB00122 D-Glucose3492.63519.8
HMDB00123 Glycine167.6178.2
HMDB00131 Glycerol54.875.3
HMDB00142 Formic acid11.40.0
HMDB00148 L-Glutamic acid68.353.1
HMDB00157 Hypoxanthine12.79.7
HMDB00158 L-Tyrosine39.438.9
HMDB00159 L-Phenylalanine38.839.4
HMDB00161 L-Alanine301.2296.5
HMDB00162 L-Proline73.570.3
HMDB00167 L-Threonine134.175.8
HMDB00168 L-Asparagine0.00.0
HMDB00172 L-Isoleucine24.935.5
HMDB00177 L-Histidine46.434.8
HMDB00182 Lysine65.774.4
HMDB00187 L-Serine179.8106.9
HMDB00190 L-Lactic acid1363.41583.9
HMDB00191 L-Aspartic acid31.50.0
HMDB00214 Ornithine3.639.2
HMDB00243 Pyruvic acid61.763.9
HMDB00254 Succinic acid3.24.0
HMDB00357 3-Hydroxybutyric acid23.820.7
HMDB00517 L-Arginine46.143.9
HMDB00562 Creatinine38.138.6
HMDB00641 L-Glutamine303.6304.9
HMDB00687 L-Leucine56.557.3
HMDB00691 Malonic acid6.611.3
HMDB00696 L-Methionine14.219.3
HMDB00863 Isopropanol12.910.7
HMDB00883 L-Valine92.2105.4
HMDB00929 L-Tryptophan15.00.0
HMDB01659 Acetone14.213.8
HMDB01873 Isobutyric acid2.73.4
HMDB01875 Methanol115.6103.4
HMDB01881 Propylene glycol8.34.8
HMDB04983 Dimethylsulfone1.23.4