Auxiliary Material: biological_serum_8

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine33.520.6
HMDB00008 2-Hydroxybutyrate13.616.8
HMDB00042 Acetic acid33.241.2
HMDB00043 Betaine17.118.1
HMDB00060 Acetoacetate0.00.9
HMDB00062 L-Carnitine23.320.9
HMDB00064 Creatine14.122.3
HMDB00094 Citric acid79.372.1
HMDB00097 Choline6.17.6
HMDB00108 Ethanol16.717.5
HMDB00122 D-Glucose3161.23444.7
HMDB00123 Glycine177.7198.0
HMDB00131 Glycerol102.988.0
HMDB00142 Formic acid9.45.5
HMDB00148 L-Glutamic acid90.898.1
HMDB00157 Hypoxanthine9.90.0
HMDB00158 L-Tyrosine49.342.1
HMDB00159 L-Phenylalanine35.735.4
HMDB00161 L-Alanine357.8381.5
HMDB00162 L-Proline110.5104.2
HMDB00167 L-Threonine141.6123.1
HMDB00168 L-Asparagine60.50.0
HMDB00172 L-Isoleucine41.055.6
HMDB00177 L-Histidine37.540.6
HMDB00182 Lysine78.592.9
HMDB00187 L-Serine306.1129.0
HMDB00190 L-Lactic acid808.7919.4
HMDB00191 L-Aspartic acid35.10.0
HMDB00214 Ornithine0.029.3
HMDB00243 Pyruvic acid31.029.4
HMDB00254 Succinic acid2.32.4
HMDB00357 3-Hydroxybutyric acid17.816.2
HMDB00517 L-Arginine53.165.6
HMDB00562 Creatinine52.653.8
HMDB00641 L-Glutamine298.0281.3
HMDB00687 L-Leucine73.789.7
HMDB00691 Malonic acid7.911.6
HMDB00696 L-Methionine20.924.4
HMDB00863 Isopropanol14.113.6
HMDB00883 L-Valine125.7138.5
HMDB00929 L-Tryptophan18.40.0
HMDB01659 Acetone10.610.0
HMDB01873 Isobutyric acid6.08.8
HMDB01875 Methanol95.995.2
HMDB01881 Propylene glycol4.14.4
HMDB04983 Dimethylsulfone1.73.2