Auxiliary Material: biological_serum_39

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine52.326.2
HMDB00008 2-Hydroxybutyrate10.312.6
HMDB00042 Acetic acid36.342.5
HMDB00043 Betaine17.015.9
HMDB00060 Acetoacetate1.35.7
HMDB00062 L-Carnitine33.729.0
HMDB00064 Creatine33.145.4
HMDB00094 Citric acid84.077.3
HMDB00097 Choline7.39.2
HMDB00108 Ethanol6.83.5
HMDB00122 D-Glucose3247.03410.9
HMDB00123 Glycine214.3239.4
HMDB00131 Glycerol108.875.1
HMDB00142 Formic acid11.39.9
HMDB00148 L-Glutamic acid75.7103.3
HMDB00157 Hypoxanthine8.40.0
HMDB00158 L-Tyrosine65.054.9
HMDB00159 L-Phenylalanine52.853.1
HMDB00161 L-Alanine360.4354.1
HMDB00162 L-Proline128.0163.1
HMDB00167 L-Threonine112.1106.9
HMDB00168 L-Asparagine18.724.2
HMDB00172 L-Isoleucine65.376.9
HMDB00177 L-Histidine42.958.0
HMDB00182 Lysine110.4109.3
HMDB00187 L-Serine215.9142.5
HMDB00190 L-Lactic acid1894.12059.3
HMDB00191 L-Aspartic acid34.90.0
HMDB00214 Ornithine0.050.5
HMDB00243 Pyruvic acid52.450.0
HMDB00254 Succinic acid3.94.6
HMDB00357 3-Hydroxybutyric acid17.824.2
HMDB00517 L-Arginine47.389.1
HMDB00562 Creatinine58.559.1
HMDB00641 L-Glutamine372.0412.4
HMDB00687 L-Leucine117.9116.6
HMDB00691 Malonic acid9.618.3
HMDB00696 L-Methionine13.415.6
HMDB00863 Isopropanol2.12.7
HMDB00883 L-Valine177.0195.0
HMDB00929 L-Tryptophan12.20.0
HMDB01659 Acetone16.016.9
HMDB01873 Isobutyric acid2.16.9
HMDB01875 Methanol55.445.1
HMDB01881 Propylene glycol0.08.8
HMDB04983 Dimethylsulfone2.47.1