Auxiliary Material: biological_serum_41

Spectrum with Fit

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HMDB IDCompound NameBayesil (µM)Expert (µM)
HMDB00001 1-Methylhistidine20.518.1
HMDB00008 2-Hydroxybutyrate10.112.3
HMDB00042 Acetic acid36.436.1
HMDB00043 Betaine22.516.8
HMDB00060 Acetoacetate0.70.7
HMDB00062 L-Carnitine15.013.3
HMDB00064 Creatine15.020.1
HMDB00094 Citric acid80.265.8
HMDB00097 Choline3.84.7
HMDB00108 Ethanol11.39.1
HMDB00122 D-Glucose3192.63517.5
HMDB00123 Glycine89.1104.9
HMDB00131 Glycerol79.271.0
HMDB00142 Formic acid11.40.0
HMDB00148 L-Glutamic acid41.555.9
HMDB00157 Hypoxanthine5.40.0
HMDB00158 L-Tyrosine29.533.9
HMDB00159 L-Phenylalanine30.030.8
HMDB00161 L-Alanine278.7282.4
HMDB00162 L-Proline113.481.0
HMDB00167 L-Threonine82.884.9
HMDB00168 L-Asparagine0.80.0
HMDB00172 L-Isoleucine26.238.1
HMDB00177 L-Histidine27.529.1
HMDB00182 Lysine63.974.3
HMDB00187 L-Serine92.972.9
HMDB00190 L-Lactic acid1083.71202.5
HMDB00191 L-Aspartic acid34.30.0
HMDB00214 Ornithine0.019.4
HMDB00243 Pyruvic acid30.030.2
HMDB00254 Succinic acid3.53.0
HMDB00357 3-Hydroxybutyric acid15.311.0
HMDB00517 L-Arginine57.142.4
HMDB00562 Creatinine37.637.9
HMDB00641 L-Glutamine269.4265.1
HMDB00687 L-Leucine50.863.0
HMDB00691 Malonic acid6.24.7
HMDB00696 L-Methionine15.617.7
HMDB00863 Isopropanol7.57.0
HMDB00883 L-Valine97.8107.7
HMDB00929 L-Tryptophan8.80.0
HMDB01659 Acetone12.612.4
HMDB01873 Isobutyric acid5.44.7
HMDB01875 Methanol52.958.5
HMDB01881 Propylene glycol8.32.7
HMDB04983 Dimethylsulfone1.62.2