Auxiliary Material: biological_serum_20

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine0.019.6
HMDB00008 2-Hydroxybutyrate15.323.3
HMDB00042 Acetic acid40.346.5
HMDB00043 Betaine30.719.1
HMDB00060 Acetoacetate0.81.0
HMDB00062 L-Carnitine17.423.1
HMDB00064 Creatine50.852.6
HMDB00094 Citric acid115.189.8
HMDB00097 Choline5.68.3
HMDB00108 Ethanol18.310.1
HMDB00122 D-Glucose3607.23629.3
HMDB00123 Glycine172.7172.0
HMDB00131 Glycerol260.8100.2
HMDB00142 Formic acid11.99.2
HMDB00148 L-Glutamic acid45.749.0
HMDB00157 Hypoxanthine8.10.0
HMDB00158 L-Tyrosine42.040.1
HMDB00159 L-Phenylalanine43.344.3
HMDB00161 L-Alanine315.6308.7
HMDB00162 L-Proline103.382.3
HMDB00167 L-Threonine69.1101.3
HMDB00168 L-Asparagine101.70.0
HMDB00172 L-Isoleucine29.143.6
HMDB00177 L-Histidine40.025.8
HMDB00182 Lysine92.3113.6
HMDB00187 L-Serine309.697.2
HMDB00190 L-Lactic acid1476.21617.8
HMDB00191 L-Aspartic acid87.30.0
HMDB00214 Ornithine23.245.3
HMDB00243 Pyruvic acid64.367.2
HMDB00254 Succinic acid2.23.2
HMDB00357 3-Hydroxybutyric acid29.520.6
HMDB00517 L-Arginine76.776.5
HMDB00562 Creatinine49.643.4
HMDB00641 L-Glutamine294.8294.1
HMDB00687 L-Leucine70.276.2
HMDB00691 Malonic acid3.96.0
HMDB00696 L-Methionine17.914.1
HMDB00863 Isopropanol4.91.4
HMDB00883 L-Valine136.1152.7
HMDB00929 L-Tryptophan12.50.0
HMDB01659 Acetone9.510.1
HMDB01873 Isobutyric acid5.97.3
HMDB01875 Methanol76.664.5
HMDB01881 Propylene glycol12.14.2
HMDB04983 Dimethylsulfone2.72.7