metabolite_name 137P 230P 237P 330P 337P 430P 437P 530P 537P 630P 637P 730P 737P 830P 837P 930P 937P 1030P 1037P 1130P Pyruvic acid 4.9E+05 1.6E+05 3.0E+05 2.3E+05 2.7E+05 3.1E+05 2.1E+05 1.3E+05 2.1E+05 4.4E+05 3.8E+05 2.1E+05 5.9E+05 1.1E+05 3.1E+05 6.9E+04 9.4E+05 1.5E+05 3.4E+05 2.5E+05 LACTATE 9.8E+06 8.4E+06 8.4E+06 2.7E+06 7.8E+06 2.1E+06 7.7E+06 9.5E+06 8.2E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.5E+06 8.2E+06 9.1E+06 8.1E+06 1.0E+07 2.5E+06 Glycolic acid 3.5E+05 6.7E+05 2.5E+05 3.7E+05 2.6E+05 4.3E+05 2.1E+05 3.3E+05 2.2E+05 5.4E+05 3.4E+05 5.0E+05 4.2E+05 5.3E+05 2.4E+05 2.8E+05 3.8E+05 4.6E+05 2.5E+05 4.5E+05 VALINE 6.0E+06 8.5E+06 4.8E+06 8.1E+06 5.1E+06 8.4E+06 4.1E+06 7.3E+06 3.4E+06 8.7E+06 6.5E+06 9.0E+06 6.6E+06 8.8E+06 3.5E+06 6.4E+06 7.3E+06 8.1E+06 3.5E+06 8.2E+06 ALANINE 9.9E+06 8.4E+06 8.4E+06 8.6E+06 7.7E+06 8.8E+06 7.0E+06 9.5E+06 8.2E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.4E+06 8.3E+06 9.1E+06 8.2E+06 9.9E+06 9.2E+06 LEUCINE 9.5E+06 8.4E+06 8.0E+06 8.6E+06 7.7E+06 8.9E+06 7.2E+06 9.0E+06 6.3E+06 8.8E+06 8.6E+06 9.2E+06 9.8E+06 8.9E+06 6.5E+06 7.7E+06 9.1E+06 8.2E+06 6.9E+06 9.1E+06 beta-Hydroxybutyric acid 4.0E+04 7.8E+04 2.8E+04 4.8E+04 2.8E+04 5.8E+04 2.2E+04 4.3E+04 2.3E+04 6.6E+04 3.8E+04 6.1E+04 4.6E+04 6.9E+04 2.6E+04 3.5E+04 3.8E+04 6.2E+04 2.8E+04 5.3E+04 ISOLEUCINE 5.3E+06 8.3E+06 4.2E+06 6.0E+06 4.5E+06 6.7E+06 3.6E+06 4.8E+06 2.9E+06 8.2E+06 5.8E+06 6.5E+06 5.8E+06 6.6E+06 3.0E+06 3.9E+06 6.8E+06 6.6E+06 3.2E+06 5.7E+06 NORVALINE 6.4E+06 8.9E+06 4.3E+06 5.8E+06 3.7E+06 5.8E+06 3.2E+06 6.3E+06 4.0E+06 7.9E+06 4.6E+06 8.4E+06 8.3E+06 8.3E+06 5.0E+06 4.8E+06 7.3E+06 8.4E+06 5.6E+06 8.1E+06 SERINE 4.0E+06 7.5E+06 3.6E+06 5.0E+06 3.8E+06 5.6E+06 3.2E+06 4.0E+06 2.6E+06 6.5E+06 4.9E+06 5.3E+06 4.6E+06 5.4E+06 2.5E+06 3.8E+06 5.0E+06 5.4E+06 2.5E+06 4.9E+06 2-Aminoethanol 7.5E+05 1.2E+06 5.3E+05 6.2E+05 5.8E+05 7.3E+05 4.3E+05 5.2E+05 4.3E+05 1.0E+06 6.8E+05 7.9E+05 8.6E+05 8.4E+05 4.6E+05 3.7E+05 9.8E+05 8.1E+05 4.9E+05 7.3E+05 Glycerol 3.1E+06 2.5E+06 2.3E+06 2.1E+06 2.2E+06 2.7E+06 2.3E+05 2.3E+06 2.0E+06 2.4E+06 2.7E+06 2.9E+06 3.3E+06 8.4E+05 2.3E+06 2.0E+06 3.0E+06 2.9E+06 2.6E+06 3.0E+06 PHOSPHOENOLPYRUVATE 9.9E+06 5.0E+06 8.4E+06 4.8E+06 7.8E+06 5.6E+06 7.7E+06 9.5E+06 8.2E+06 5.1E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.5E+06 5.0E+06 9.1E+06 8.2E+06 1.0E+07 9.2E+06 Nicotinic acid 2.1E+05 3.7E+05 1.7E+05 2.1E+05 1.8E+05 2.8E+05 1.4E+05 1.7E+05 1.3E+05 3.0E+05 2.3E+05 2.6E+05 2.4E+05 2.8E+05 1.4E+05 1.4E+05 2.5E+05 2.9E+05 1.3E+05 2.5E+05 THREONINE 3.4E+06 6.6E+06 3.6E+06 5.4E+06 3.7E+06 5.6E+06 3.4E+06 5.1E+06 2.9E+06 6.1E+06 4.5E+06 5.5E+06 4.3E+06 5.7E+06 2.4E+06 4.9E+06 4.0E+06 6.0E+06 2.6E+06 5.6E+06 GLYCINE 9.8E+06 8.4E+06 8.3E+06 8.6E+06 7.8E+06 8.9E+06 7.4E+06 9.5E+06 7.8E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.0E+06 8.3E+06 9.1E+06 8.2E+06 9.5E+06 9.2E+06 Succinic acid 9.8E+06 8.4E+06 8.4E+06 8.5E+06 7.8E+06 8.8E+06 7.7E+06 9.4E+06 8.2E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.8E+06 9.4E+06 8.2E+06 9.1E+06 8.1E+06 9.8E+06 9.1E+06 Glyceric acid 3.1E+05 4.0E+05 2.4E+05 1.9E+05 2.6E+05 2.3E+05 2.0E+05 1.3E+05 1.8E+05 2.6E+05 3.3E+05 1.8E+05 3.5E+05 2.1E+05 2.1E+05 9.4E+04 4.1E+05 1.8E+05 2.1E+05 1.7E+05 URACIL 1.8E+06 3.9E+06 1.4E+06 2.0E+06 1.4E+06 2.5E+06 9.9E+05 1.7E+06 9.9E+05 2.9E+06 1.7E+06 2.3E+06 1.7E+06 2.6E+06 9.9E+05 1.5E+06 1.7E+06 3.0E+06 1.0E+06 2.4E+06 FUMARATE 1.1E+05 9.2E+05 9.3E+04 4.4E+05 9.2E+04 5.4E+05 8.7E+04 3.0E+05 6.3E+04 5.3E+05 1.2E+05 4.5E+05 1.2E+05 4.8E+05 7.7E+04 2.7E+05 1.3E+05 4.4E+05 7.5E+04 3.6E+05 Glutaric acid 2.2E+04 6.3E+04 1.7E+04 2.1E+04 1.8E+04 2.7E+04 1.3E+04 1.4E+04 1.3E+04 3.5E+04 2.1E+04 1.9E+04 2.4E+04 2.6E+04 1.4E+04 1.3E+04 3.0E+04 3.1E+04 1.3E+04 2.4E+04 THYMINE 2.8E+05 1.3E+06 2.0E+05 6.0E+05 2.2E+05 4.3E+05 1.5E+05 5.4E+05 1.4E+05 8.8E+05 2.8E+05 8.5E+05 2.9E+05 9.6E+05 1.4E+05 5.8E+05 3.4E+05 1.2E+06 1.5E+05 8.7E+05 THYMIDINE 1.6E+05 9.7E+05 1.5E+05 3.0E+05 1.7E+05 2.8E+05 1.4E+05 2.3E+05 1.1E+05 5.3E+05 2.5E+05 3.0E+05 1.7E+05 3.6E+05 9.3E+04 3.2E+05 2.0E+05 6.3E+05 1.0E+05 2.9E+05 BETA-ALANINE 3.6E+04 8.2E+04 2.6E+04 4.0E+04 3.0E+04 5.1E+04 2.3E+04 3.4E+04 2.0E+04 6.6E+04 3.7E+04 4.1E+04 4.1E+04 5.6E+04 2.1E+04 2.8E+04 4.7E+04 6.1E+04 2.1E+04 4.8E+04 beta-N-Methyl-amino-L-alanine 1.3E+06 1.6E+06 8.2E+05 9.4E+05 6.4E+05 9.2E+05 4.0E+05 1.8E+06 6.2E+05 1.3E+06 5.2E+05 2.3E+06 1.1E+06 2.4E+06 9.8E+05 1.1E+06 7.4E+05 2.3E+06 7.0E+05 1.6E+06 Homoserine 3.5E+05 1.6E+06 2.3E+05 7.1E+05 2.2E+05 3.3E+05 1.4E+05 1.2E+06 2.0E+05 1.1E+06 1.3E+05 2.9E+06 3.1E+05 1.9E+06 2.2E+05 9.4E+05 1.9E+05 1.5E+06 1.6E+05 1.0E+06 trans-4-hydroxy-L-proline 2.2E+04 7.3E+04 2.2E+04 5.2E+04 2.3E+04 5.0E+04 1.8E+04 4.6E+04 1.4E+04 6.9E+04 2.8E+04 5.2E+04 2.4E+04 6.9E+04 1.5E+04 4.6E+04 2.6E+04 7.3E+04 1.5E+04 5.5E+04 Citramalic acid 4.3E+04 3.8E+05 3.5E+04 1.8E+05 4.0E+04 2.0E+05 3.6E+04 1.0E+05 2.8E+04 1.8E+05 6.0E+04 9.0E+04 5.4E+04 1.2E+05 2.7E+04 6.5E+04 5.5E+04 8.9E+04 2.4E+04 8.2E+04 MALIC ACID 1.2E+06 5.1E+06 1.0E+06 3.4E+06 9.9E+05 4.0E+06 9.0E+05 3.0E+06 7.3E+05 4.5E+06 1.3E+06 3.6E+06 1.3E+06 4.1E+06 8.1E+05 2.1E+06 1.4E+06 3.0E+06 8.4E+05 2.9E+06 Asparagine 1.7E+05 2.7E+05 1.5E+05 9.9E+04 1.5E+05 2.1E+05 1.1E+05 1.4E+05 9.6E+04 2.1E+05 1.5E+05 1.8E+05 2.1E+05 1.5E+05 1.2E+05 1.0E+05 2.8E+05 1.7E+05 9.0E+04 2.3E+05 THREITOL 3.1E+05 8.0E+05 2.6E+05 3.7E+05 2.7E+05 4.2E+05 2.3E+05 3.0E+05 2.1E+05 6.0E+05 3.4E+05 5.1E+05 3.5E+05 5.8E+05 2.1E+05 2.5E+05 2.5E+05 3.2E+06 2.0E+05 4.7E+05 METHIONINE 2.0E+06 2.6E+06 1.4E+06 1.3E+06 1.3E+06 1.6E+06 9.4E+05 1.5E+06 1.1E+06 2.6E+06 1.2E+06 2.2E+06 2.5E+06 1.8E+06 1.3E+06 9.9E+05 3.0E+06 1.9E+06 1.3E+06 1.7E+06 GLUTAMINE 9.9E+06 8.4E+06 8.4E+06 8.6E+06 7.8E+06 8.9E+06 7.7E+06 9.5E+06 8.2E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.5E+06 8.3E+06 9.1E+06 8.2E+06 1.0E+07 9.2E+06 ASPARTATE 8.9E+06 9.9E+05 6.1E+06 3.8E+06 4.3E+06 4.2E+06 3.9E+06 5.7E+06 5.2E+06 1.3E+06 4.4E+06 4.1E+06 1.0E+07 5.8E+06 7.0E+06 5.0E+06 9.9E+06 2.9E+06 6.2E+06 4.3E+06 CYTOSINE 4.5E+04 5.9E+05 2.1E+05 3.3E+05 2.2E+05 5.5E+04 3.2E+04 2.0E+05 1.2E+05 7.1E+04 2.8E+05 2.2E+05 5.7E+04 1.9E+05 1.4E+05 1.1E+05 6.6E+04 2.3E+05 1.5E+05 2.1E+05 GABA 8.5E+06 3.8E+06 5.6E+06 6.5E+06 4.8E+06 4.5E+06 4.2E+06 6.4E+06 4.5E+06 4.8E+06 5.7E+06 5.9E+06 8.1E+06 6.9E+06 5.8E+06 6.0E+06 5.9E+06 5.3E+06 6.8E+06 5.1E+06 Threonic acid 9.1E+04 1.7E+05 6.5E+04 8.3E+04 6.8E+04 8.9E+04 5.6E+04 6.8E+04 5.0E+04 1.2E+05 9.3E+04 9.1E+04 1.0E+05 1.0E+05 5.2E+04 5.0E+04 1.1E+05 9.6E+04 5.9E+04 8.4E+04 CYSTEINE 5.3E+04 2.6E+04 3.6E+04 2.7E+04 4.6E+04 4.0E+04 3.6E+04 2.9E+04 3.5E+04 5.8E+04 5.0E+04 3.8E+04 5.9E+04 5.8E+04 3.8E+04 1.7E+04 6.7E+04 4.9E+04 3.3E+04 4.8E+04 PROLINE 4.8E+05 2.0E+06 4.5E+05 1.1E+06 5.2E+05 1.4E+06 5.2E+05 8.2E+05 2.8E+05 1.3E+06 7.4E+05 1.2E+06 5.7E+05 1.2E+06 2.7E+05 8.8E+05 7.9E+05 1.5E+06 2.5E+05 1.0E+06 3-Phenyllactic acid 1.4E+06 2.9E+06 9.9E+05 1.7E+06 9.5E+05 1.7E+06 8.0E+05 1.5E+06 7.0E+05 2.3E+06 1.4E+06 1.9E+06 1.4E+06 2.1E+06 7.3E+05 1.3E+06 1.4E+06 2.1E+06 7.0E+05 1.9E+06 Hypotaurine 2.8E+04 4.3E+04 2.3E+04 2.4E+04 2.2E+04 3.0E+04 1.9E+04 1.8E+04 1.6E+04 3.9E+04 2.9E+04 2.6E+04 3.4E+04 3.0E+04 1.8E+04 1.3E+04 3.7E+04 2.8E+04 1.9E+04 2.5E+04 3-Hydroxy-3-methylglutarate 1.6E+04 1.7E+03 1.2E+04 1.4E+04 1.3E+04 2.1E+04 1.1E+04 1.5E+04 9.9E+03 1.6E+04 1.8E+04 1.4E+04 1.8E+04 2.0E+04 1.2E+04 1.0E+04 1.9E+04 1.5E+04 1.1E+04 1.6E+04 GLUTAMATE 9.9E+06 2.7E+06 8.3E+06 8.6E+06 7.6E+06 8.8E+06 5.7E+06 9.5E+06 7.4E+06 8.8E+06 8.6E+06 9.2E+06 1.0E+07 8.9E+06 9.2E+06 8.3E+06 9.1E+06 8.2E+06 9.6E+06 9.2E+06 PHENYLALANINE 4.6E+06 8.6E+06 3.5E+06 2.8E+06 3.6E+06 4.7E+06 2.8E+06 3.0E+06 2.9E+06 5.2E+06 4.4E+06 4.9E+06 5.2E+06 5.1E+06 3.2E+06 2.1E+06 8.7E+06 5.9E+06 2.9E+06 4.3E+06 N-Acetyl aspartic acid 4.7E+04 9.3E+04 3.3E+04 4.8E+04 3.8E+04 6.4E+04 2.6E+04 4.3E+04 2.5E+04 6.3E+04 4.9E+04 5.0E+04 5.3E+04 7.4E+04 3.0E+04 4.0E+04 5.2E+04 8.8E+04 2.8E+04 5.6E+04 Lyxose 1.2E+05 9.2E+04 1.1E+05 1.1E+05 9.0E+04 1.2E+05 9.4E+04 6.5E+04 6.7E+04 1.3E+05 1.3E+05 1.3E+05 8.7E+04 8.4E+04 7.7E+04 3.4E+04 1.4E+05 1.0E+05 1.1E+05 1.2E+05 Ribose 5.5E+04 1.1E+05 3.9E+04 6.5E+04 4.5E+04 6.8E+04 3.6E+04 4.7E+04 2.9E+04 8.8E+04 6.1E+04 5.9E+04 6.8E+04 7.3E+04 3.5E+04 2.6E+04 6.1E+04 6.3E+04 3.3E+04 5.0E+04 Xylulose+Ribulose 3.3E+06 2.3E+06 2.7E+06 1.5E+06 2.8E+06 2.3E+06 2.4E+06 1.0E+06 2.2E+06 2.4E+06 3.3E+06 1.7E+06 3.8E+06 1.5E+06 2.7E+06 6.3E+05 3.9E+06 1.5E+06 2.9E+06 1.5E+06 1,6-Anhydroglucose 2.7E+04 4.8E+04 2.6E+04 5.0E+04 2.4E+04 4.2E+04 2.2E+04 2.8E+04 1.7E+04 3.7E+04 3.5E+04 2.9E+04 3.0E+04 2.8E+04 2.0E+04 2.1E+04 3.3E+04 2.7E+04 2.1E+04 2.7E+04 Ribitol 1.3E+05 1.9E+05 1.0E+05 9.0E+04 1.1E+05 1.0E+05 7.3E+04 6.2E+04 6.4E+04 1.6E+05 1.4E+05 7.8E+04 1.4E+05 9.1E+04 7.0E+04 3.9E+04 1.8E+05 9.0E+04 6.2E+04 7.8E+04 Glucose-1-Phosphate 1.8E+06 1.8E+06 1.8E+06 1.4E+06 1.8E+06 3.6E+06 1.6E+06 1.1E+06 1.6E+06 1.9E+06 2.2E+06 1.9E+06 2.6E+06 2.3E+06 1.8E+06 9.2E+05 1.8E+06 2.5E+06 1.6E+06 2.3E+06 Arabitol 1.1E+05 1.8E+06 1.8E+06 1.4E+06 1.8E+06 3.6E+06 1.6E+06 1.1E+06 1.6E+06 1.9E+06 2.2E+06 1.9E+06 2.6E+06 2.3E+06 1.8E+06 9.2E+05 1.8E+06 2.5E+06 1.6E+06 2.3E+06 Glycerol-2-phosphate+glycerol 3-phosphate 3.6E+04 7.0E+04 3.0E+04 6.6E+04 2.8E+04 5.7E+04 2.4E+04 4.5E+04 1.6E+04 5.0E+04 3.6E+04 3.9E+04 4.4E+04 4.2E+04 2.3E+04 4.9E+04 4.0E+04 4.3E+04 2.1E+04 4.3E+04 PUTRESCINE 2.8E+06 8.2E+06 2.8E+06 6.4E+06 2.9E+06 6.3E+06 2.3E+06 4.8E+06 2.0E+06 7.5E+06 3.6E+06 6.2E+06 3.4E+06 6.3E+06 2.1E+06 3.5E+06 3.5E+06 6.9E+06 1.7E+06 5.5E+06 ACONITATE 2.8E+05 8.1E+05 2.6E+05 5.5E+05 2.7E+05 5.5E+05 2.1E+05 4.1E+05 1.9E+05 6.4E+05 3.3E+05 5.3E+05 3.3E+05 5.5E+05 2.0E+05 3.1E+05 3.3E+05 6.0E+05 1.7E+05 4.8E+05 O-Phosphoethanolamine 3.2E+04 5.4E+04 2.6E+04 2.5E+04 2.8E+04 3.3E+04 2.1E+04 1.9E+04 1.8E+04 4.5E+04 3.6E+04 2.6E+04 3.8E+04 3.0E+04 2.0E+04 1.3E+04 4.9E+04 2.7E+04 2.0E+04 2.6E+04 Xylonic acid 6.2E+04 1.6E+05 4.9E+04 6.7E+04 5.1E+04 8.0E+04 4.4E+04 5.6E+04 3.5E+04 9.1E+04 7.0E+04 6.4E+04 8.5E+04 8.2E+04 3.9E+04 4.3E+04 8.2E+04 7.9E+04 4.2E+04 6.8E+04 CARBAMOYL ASPARTATE 1.0E+04 2.7E+04 7.3E+03 9.8E+03 7.5E+03 1.5E+04 7.4E+03 7.2E+03 5.7E+03 1.5E+04 1.1E+04 1.1E+04 1.3E+04 1.3E+04 5.4E+03 6.9E+03 1.2E+04 1.5E+04 5.8E+03 1.2E+04 Hypoxanthine 4.7E+05 2.4E+06 2.6E+05 5.8E+05 3.5E+05 7.4E+05 2.3E+05 4.9E+05 2.1E+05 1.2E+06 4.6E+05 6.9E+05 5.3E+05 1.1E+06 2.7E+05 2.3E+05 7.2E+05 8.1E+05 2.4E+05 6.1E+05 SHIKIMIC ACID 3.7E+04 1.6E+05 2.8E+04 1.7E+05 2.8E+04 1.7E+05 2.4E+04 1.2E+05 2.1E+04 1.7E+05 3.9E+04 1.3E+05 4.4E+04 1.6E+05 2.2E+04 8.8E+04 5.0E+04 2.1E+05 2.4E+04 1.6E+05 ORNITHINE 1.9E+06 5.2E+06 1.3E+06 3.4E+06 1.3E+06 3.3E+06 1.1E+06 3.4E+06 9.2E+05 3.9E+06 1.6E+06 4.6E+06 2.5E+06 5.4E+06 1.3E+06 2.4E+06 2.0E+06 6.2E+06 1.2E+06 5.3E+06 CITRATE 8.9E+06 2.8E+06 7.3E+06 1.2E+06 7.4E+06 2.1E+06 6.4E+06 1.5E+06 6.4E+06 2.3E+06 8.3E+06 3.3E+06 9.7E+06 3.6E+06 7.0E+06 1.0E+06 9.0E+06 3.1E+06 8.0E+06 2.0E+06 ARGININE 5.8E+06 8.3E+06 5.5E+06 8.4E+06 5.8E+06 8.5E+06 4.6E+06 7.1E+06 4.1E+06 8.8E+06 7.4E+06 8.5E+06 6.7E+06 8.6E+06 4.9E+06 5.4E+06 7.8E+06 7.9E+06 2.7E+06 8.8E+06 Adenine 3.4E+06 7.4E+06 2.3E+06 2.8E+06 3.1E+06 4.0E+06 2.0E+06 2.0E+06 2.1E+06 5.2E+06 3.5E+06 3.0E+06 3.7E+06 3.6E+06 2.2E+06 1.6E+06 4.5E+06 4.5E+06 2.0E+06 3.5E+06 FRUCTOSE 2.2E+06 6.4E+05 1.3E+06 3.1E+05 1.3E+06 1.0E+06 9.4E+05 1.3E+05 8.1E+05 7.7E+05 2.1E+06 3.5E+05 2.5E+06 2.7E+05 9.8E+05 5.5E+04 3.2E+06 2.2E+05 1.3E+06 3.6E+05 MANNOSE 1.8E+06 8.5E+04 1.4E+06 1.5E+06 1.4E+06 1.8E+06 1.2E+06 1.2E+06 1.1E+06 2.2E+06 1.7E+06 1.8E+06 1.9E+06 1.9E+06 1.2E+06 8.3E+05 2.1E+06 2.0E+06 1.3E+06 1.8E+06 Tyramine 1.8E+06 2.3E+06 1.4E+06 1.5E+06 1.4E+06 1.8E+06 1.2E+06 1.2E+06 1.1E+06 2.2E+06 1.7E+06 1.8E+06 1.9E+06 1.9E+06 1.2E+06 8.2E+05 2.0E+06 2.0E+06 1.3E+06 1.8E+06 GALACTOSE 1.5E+06 2.5E+06 1.0E+06 1.1E+05 1.2E+06 2.0E+06 6.5E+05 6.8E+04 9.6E+05 2.4E+06 1.8E+06 1.3E+05 1.0E+07 1.9E+06 7.9E+05 2.4E+04 9.1E+06 9.2E+04 1.0E+07 8.9E+04 GLUCOSE 2.4E+07 9.0E+06 1.3E+07 1.4E+07 8.5E+06 9.0E+06 8.0E+06 2.7E+07 1.1E+07 1.0E+07 9.9E+06 3.0E+07 1.8E+07 1.7E+07 2.1E+07 5.5E+06 1.1E+07 9.0E+06 5.4E+06 1.2E+07 LYSINE 7.7E+05 6.1E+05 1.8E+05 7.5E+05 1.8E+05 7.7E+05 2.2E+05 9.5E+05 1.9E+05 2.1E+05 1.7E+05 1.3E+06 1.0E+06 1.6E+06 3.3E+05 8.1E+05 6.1E+05 2.1E+06 1.0E+06 1.5E+06 Tyrosine 2.7E+06 3.0E+06 9.3E+05 1.3E+06 1.2E+06 1.7E+06 1.2E+06 1.5E+06 7.0E+05 1.9E+06 1.2E+06 2.7E+06 3.9E+06 3.1E+06 1.0E+06 1.2E+06 3.3E+06 3.8E+06 3.0E+06 2.6E+06 Mannitol 4.9E+06 8.2E+06 3.3E+06 4.9E+06 3.9E+06 6.0E+06 3.2E+06 3.9E+06 2.6E+06 7.3E+06 5.0E+06 5.9E+06 5.8E+06 6.4E+06 3.1E+06 2.7E+06 5.4E+06 5.4E+06 3.3E+06 5.2E+06 IDITOL 2.0E+05 2.6E+05 1.3E+05 1.3E+05 1.4E+05 1.7E+05 1.2E+05 9.2E+04 1.0E+05 2.1E+05 2.0E+05 1.5E+05 2.2E+05 1.6E+05 1.1E+05 5.9E+04 2.0E+05 1.5E+05 1.1E+05 1.4E+05 Pantothenate 2.9E+04 3.8E+05 2.1E+04 2.4E+04 1.3E+05 1.0E+05 9.8E+04 7.2E+04 4.7E+04 2.1E+05 1.3E+05 6.0E+04 2.7E+05 1.0E+05 6.4E+04 2.2E+04 1.6E+05 6.1E+04 1.8E+04 3.7E+04 DEOXYURIDINE-3-PHOSPHATE 9.2E+05 8.6E+06 8.7E+05 9.5E+05 7.0E+06 5.6E+06 5.7E+06 4.2E+06 2.7E+06 8.9E+06 7.4E+06 3.2E+06 1.0E+07 5.5E+06 3.7E+06 1.1E+06 8.7E+06 3.3E+06 8.1E+05 1.9E+06 Gluconic acid 7.1E+04 8.2E+04 8.4E+04 4.2E+04 4.6E+04 5.5E+04 4.8E+04 2.2E+04 4.9E+04 4.6E+04 6.5E+04 2.0E+04 7.5E+04 2.7E+04 5.3E+04 1.3E+04 8.6E+04 2.1E+04 3.7E+04 2.0E+04 N-Acetyl-D-glucosamine 3.4E+06 2.4E+06 2.6E+06 9.4E+05 2.6E+06 1.9E+06 2.2E+06 7.0E+05 1.8E+06 2.5E+06 3.3E+06 1.2E+06 3.7E+06 1.3E+06 2.2E+06 1.4E+05 4.4E+06 6.4E+05 2.5E+06 8.8E+05 Dopamine 3.5E+05 5.9E+05 2.6E+05 3.2E+05 2.7E+05 4.2E+05 2.2E+05 2.1E+05 1.8E+05 5.3E+05 3.8E+05 3.5E+05 4.1E+05 3.9E+05 2.1E+05 1.1E+05 4.8E+05 3.6E+05 2.1E+05 3.3E+05 MYO-INOSITOL 2.1E+06 3.3E+06 1.6E+06 1.7E+06 1.7E+06 2.3E+06 1.5E+06 1.2E+06 1.2E+06 2.7E+06 2.2E+06 1.8E+06 2.6E+06 1.9E+06 1.3E+06 8.2E+05 2.9E+06 1.8E+06 1.4E+06 1.7E+06 Guanine 1.5E+06 1.1E+06 6.8E+05 5.0E+04 4.4E+05 5.7E+04 5.3E+05 9.3E+04 3.4E+05 8.2E+05 1.1E+06 5.3E+05 1.6E+06 1.9E+05 6.1E+05 7.3E+04 2.3E+06 6.0E+04 8.9E+05 9.6E+04 RIBULOSE-5-PHOSPHATE 2.1E+04 4.6E+05 5.8E+04 1.8E+04 6.9E+04 5.2E+04 1.9E+04 1.5E+04 3.4E+04 2.4E+04 8.2E+04 2.7E+04 2.6E+04 2.0E+05 5.1E+04 5.3E+04 2.9E+04 1.2E+04 1.5E+04 3.6E+04 XYLULOSE-5-PHOSPHATE 4.2E+05 4.7E+05 3.4E+05 2.1E+05 4.1E+05 3.5E+05 3.6E+05 1.9E+05 2.1E+05 5.2E+05 5.2E+05 1.5E+05 5.2E+05 2.1E+05 2.9E+05 5.5E+04 5.8E+05 1.6E+05 2.4E+05 1.9E+05 6-METHYLINDOLE 1.2E+05 4.5E+05 1.8E+05 2.6E+05 1.6E+05 3.8E+05 1.1E+05 2.0E+05 7.6E+04 2.9E+05 2.2E+05 1.5E+05 9.1E+04 2.2E+05 1.2E+05 1.7E+05 1.1E+05 2.9E+05 7.9E+04 2.0E+05 MANNOHEPTULOSE 5.4E+04 6.2E+04 2.9E+04 3.1E+04 4.2E+04 5.5E+04 2.6E+04 2.2E+04 2.2E+04 5.5E+04 4.2E+04 3.4E+04 6.5E+04 3.6E+04 2.5E+04 1.1E+04 7.7E+04 3.2E+04 3.3E+04 3.3E+04 Elaidic acid 5.4E+05 4.8E+05 4.8E+05 4.4E+05 4.2E+05 3.5E+05 4.4E+05 3.6E+05 3.2E+05 4.4E+05 5.5E+05 4.7E+05 6.0E+05 3.1E+05 3.7E+05 3.3E+05 7.1E+05 3.5E+05 4.7E+05 3.4E+05 TRYPTOPHAN 6.9E+05 1.3E+07 1.7E+05 5.1E+04 5.9E+06 3.1E+05 6.5E+06 5.5E+04 1.0E+05 3.9E+05 4.4E+05 2.0E+05 2.2E+06 6.1E+02 1.3E+05 3.7E+04 4.8E+06 2.0E+05 8.8E+05 1.6E+05 FRUCTOSE-6-PHOSPHATE 4.1E+05 1.2E+06 3.0E+05 9.3E+05 3.5E+05 7.9E+05 3.0E+05 6.3E+05 1.8E+05 7.8E+05 5.9E+05 4.2E+05 5.1E+05 5.8E+05 2.6E+05 3.7E+05 5.7E+05 4.7E+05 2.7E+05 5.0E+05 2-Deoxyuridine 7.2E+04 5.8E+04 4.6E+04 5.0E+04 5.6E+04 7.0E+04 4.0E+04 2.5E+04 3.4E+04 7.3E+04 7.7E+04 4.5E+04 3.8E+04 4.9E+04 4.2E+04 1.5E+04 7.4E+04 6.7E+04 4.6E+04 6.0E+04 GLUCOSE-6-PHOSPHATE 1.5E+06 2.4E+06 1.0E+06 1.8E+06 1.3E+06 1.8E+06 1.2E+06 1.2E+06 7.1E+05 1.8E+06 2.1E+06 9.9E+05 1.8E+06 1.2E+06 1.0E+06 3.7E+05 1.9E+06 8.7E+05 1.0E+06 9.9E+05 Sorbitol 6-phosphate 8.2E+04 1.7E+05 3.3E+04 1.2E+05 5.4E+04 1.3E+05 4.6E+04 7.8E+04 2.2E+04 7.5E+04 1.2E+05 4.7E+04 9.5E+04 4.4E+04 4.1E+04 2.9E+04 1.0E+05 4.2E+04 5.5E+04 3.2E+04 Uridine 1.9E+04 2.9E+04 1.3E+04 1.9E+04 1.8E+04 2.3E+04 1.6E+04 1.5E+04 9.6E+03 2.3E+04 2.4E+04 1.3E+04 1.9E+04 1.3E+04 1.2E+04 6.1E+03 2.6E+04 1.3E+04 1.5E+04 1.0E+04 N-Acetyl glucosamine 6-phosphate 2.4E+04 1.1E+05 1.6E+04 9.3E+04 2.1E+04 1.2E+05 1.5E+04 5.0E+04 8.1E+03 4.0E+04 6.6E+04 2.5E+04 3.1E+04 3.5E+04 1.3E+04 4.2E+04 2.8E+04 6.4E+04 1.1E+04 5.1E+04 Adenosine 2.3E+04 1.2E+05 2.0E+04 7.3E+04 1.9E+04 1.3E+05 1.6E+04 2.3E+04 8.4E+03 3.8E+04 3.3E+04 2.0E+04 3.8E+04 2.2E+04 1.2E+04 1.5E+04 4.4E+04 2.0E+04 1.2E+04 2.7E+04 MALTOSE 9.4E+06 8.4E+06 7.0E+06 4.5E+04 7.2E+06 8.7E+06 6.5E+06 9.4E+06 5.8E+06 7.7E+06 8.7E+06 8.1E+06 1.0E+07 8.8E+06 7.6E+06 8.2E+06 8.5E+06 8.1E+06 6.8E+04 9.2E+06 Trehalose 9.8E+06 8.4E+06 8.4E+06 8.6E+06 7.8E+06 8.8E+06 7.7E+06 9.5E+06 8.0E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.5E+06 8.2E+06 9.0E+06 8.1E+06 9.9E+06 9.2E+06 SUCROSE 9.9E+06 1.1E+06 8.4E+06 8.6E+06 7.8E+06 8.9E+06 7.7E+06 9.5E+06 8.2E+06 8.8E+06 8.7E+06 9.2E+06 1.0E+07 8.9E+06 9.5E+06 8.3E+06 9.1E+06 8.2E+06 8.0E+06 9.2E+06 CELLOBIOSE 4.9E+05 4.9E+05 2.6E+05 2.2E+05 3.1E+05 3.1E+05 2.2E+05 1.7E+05 1.6E+05 3.6E+05 5.4E+05 1.9E+05 7.1E+05 2.2E+05 2.1E+05 1.0E+05 1.0E+06 2.0E+05 2.4E+05 2.1E+05 Lactitol 9.4E+04 1.5E+05 6.4E+04 6.5E+04 7.3E+04 9.5E+04 6.0E+04 4.1E+04 4.2E+04 1.2E+05 1.0E+05 5.8E+04 1.3E+05 6.8E+04 5.7E+04 2.1E+04 1.7E+05 5.2E+04 5.6E+04 5.8E+04 Sucrose-6-phosphate 9.1E+04 1.4E+05 9.6E+04 5.5E+04 8.9E+04 7.2E+04 6.8E+04 2.5E+04 5.4E+04 7.3E+04 1.8E+05 2.2E+04 1.5E+05 2.9E+04 6.2E+04 1.1E+04 1.9E+05 3.1E+04 4.3E+04 3.2E+04 metabolite_name Reference RI Quant mass Formula INCHIKEY Pyruvic acid 1045 174 C3H4O3 LCTONWCANYUPML-UHFFFAOYSA-N LACTATE 1071 73 C3H6O3 JVTAAEKCZFNVCJ-UHFFFAOYSA-M Glycolic acid 1068 147 C2H4O3 AEMRFAOFKBGASW-UHFFFAOYSA-N VALINE 1095 72 C5H11NO2 KZSNJWFQEVHDMF-BYPYZUCNSA-N ALANINE 1113 116 C3H7NO2 QNAYBMKLOCPYGJ-UHFFFAOYSA-N LEUCINE 1165 86 C6H13NO2 ROHFNLRQFUQHCH-YFKPBYRVSA-N beta-Hydroxybutyric acid 1151 191 C4H8O3 WHBMMWSBFZVSSR-UHFFFAOYNA-N ISOLEUCINE 1186 86 C6H13NO2 AGPKZVBTJJNPAG-WHFBIAKZSA-N NORVALINE 1256 144 C5H11NO2 SNDPXSYFESPGGJ-BYPYZUCNSA-N SERINE 1272 132 C3H7NO3 MTCFGRXMJLQNBG-REOHCLBHSA-N 2-Aminoethanol 1275 174 C2H7NO HZAXFHJVJLSVMW-UHFFFAOYSA-N Glycerol 1281 147 C3H8O3 PEDCQBHIVMGVHV-UHFFFAOYSA-N PHOSPHOENOLPYRUVATE 1293 299 C3H5O6P DTBNBXWJWCWCIK-UHFFFAOYSA-N Nicotinic acid 1297 180 C6H5NO2 PVNIIMVLHYAWGP-UHFFFAOYSA-N THREONINE 1311 73 C4H9NO3 AYFVYJQAPQTCCC-GBXIJSLDSA-N GLYCINE 1324 174 C2H5NO2 DHMQDGOQFOQNFH-UHFFFAOYSA-N Succinic acid 1304 147 C4H6O4 KDYFGRWQOYBRFD-UHFFFAOYSA-N Glyceric acid 1339 147 C3H6O4 RBNPOMFGQQGHHO-UHFFFAOYSA-N URACIL 1354 241 C4H4N2O2 ISAKRJDGNUQOIC-UHFFFAOYSA-N FUMARATE 1359 245 C4H4O4 VZCYOOQTPOCHFL-OWOJBTEDSA-N Glutaric acid 1395 243 C5H8O4 JFCQEDHGNNZCLN-UHFFFAOYSA-N THYMINE 1418 255 C5H6N2O2 RWQNBRDOKXIBIV-UHFFFAOYSA-N THYMIDINE 1418 73 C10H14N2O5 IQFYYKKMVGJFEH-XLPZGREQSA-N BETA-ALANINE 1443 174 C3H7NO2 UCMIRNVEIXFBKS-UHFFFAOYSA-N beta-N-Methyl-amino-L-alanine 1458 116 C4H10N2O2 UJVHVMNGOZXSOZ-UHFFFAOYNA-N Homoserine 1458 218 C4H9NO3 UKAUYVFTDYCKQA-UHFFFAOYSA-N trans-4-hydroxy-L-proline 1468 158 C5H9NO3 PMMYEEVYMWASQN-DMTCNVIQSA-N Citramalic acid 1485 247 C5H8O5 XFTRTWQBIOMVPK-UHFFFAOYSA-N MALIC ACID 1513 73 C4H6O5 BJEPYKJPYRNKOW-UHFFFAOYSA-N Asparagine 1502 243 C4H8N2O3 DCXYFEDJOCDNAF-REOHCLBHSA-N THREITOL 1526 217 C4H10O4 UNXHWFMMPAWVPI-QWWZWVQMSA-N METHIONINE 1539 176 C5H11NO2S FFEARJCKVFRZRR-BYPYZUCNSA-N GLUTAMINE 1542 156 C5H10N2O3 ZDXPYRJPNDTMRX-VKHMYHEASA-N ASPARTATE 1544 232 C4H7NO4 CKLJMWTZIZZHCS-REOHCLBHSA-N CYTOSINE 1543 254 C4H5N3O OPTASPLRGRRNAP-UHFFFAOYSA-N GABA 1549 174 C4H9NO2 BTCSSZJGUNDROE-UHFFFAOYSA-N Threonic acid 1575 292 C4H8O5 JPIJQSOTBSSVTP-UHFFFAOYSA-N CYSTEINE 1577 115 C3H7NO2S XUJNEKJLAYXESH-REOHCLBHSA-N PROLINE 1595 142 C5H9NO2 ONIBWKKTOPOVIA-BYPYZUCNSA-N 3-Phenyllactic acid 1597 193 C9H10O3 VOXXWSYKYCBWHO-UHFFFAOYSA-N Hypotaurine 1598 188 C2H7NO2S VVIUBCNYACGLLV-UHFFFAOYNA-N 3-Hydroxy-3-methylglutarate 1613 247 C6H10O5 NPOAOTPXWNWTSH-UHFFFAOYSA-N GLUTAMATE 1642 246 C5H9NO4 WHUUTDBJXJRKMK-VKHMYHEASA-N PHENYLALANINE 1646 218 C9H11NO2 COLNVLDHVKWLRT-QMMMGPOBSA-N N-Acetyl aspartic acid 1664 158 C6H9NO5 OTCCIMWXFLJLIA-BYPYZUCNSA-N Lyxose 1683 103 C5H10O5 PYMYPHUHKUWMLA-UOWFLXDJSA-N Ribose 1698 217 C5H10O5 PYMYPHUHKUWMLA-LMVFSUKVSA-N Xylulose+Ribulose 1699 73 C5H10O5 ZAQJHHRNXZUBTE-WUJLRWPWSA-N & ZAQJHHRNXZUBTE-NQXXGFSBSA-N 1,6-Anhydroglucose 1725 204 C6H10O5 TWNIBLMWSKIRAT-VFUOTHLCSA-N Ribitol 1755 86 C5H12O5 HEBKCHPVOIAQTA-UHFFFAOYNA-N Glucose-1-Phosphate 1733 217 C6H13O9P HXXFSFRBOHSIMQ-GASJEMHNSA-N Arabitol 1745 217 C5H12O5 HEBKCHPVOIAQTA-QWWZWVQMSA-N Glycerol-2-phosphate+glycerol 3-phosphate 1743 299 C3H9O6P DHCLVCXQIBBOPH-UHFFFAOYSA-N PUTRESCINE 1758 174 C4H12N2 KIDHWZJUCRJVML-UHFFFAOYSA-N ACONITATE 1771 147 C6H6O6 GTZCVFVGUGFEME-HNQUOIGGSA-N O-Phosphoethanolamine 1803 299 C2H8NO4P SUHOOTKUPISOBE-UHFFFAOYSA-N Xylonic acid 1792 292 C5H10O6 QXKAIJAYHKCRRA-NUNKFHFFSA-N CARBAMOYL ASPARTATE 1819 257 C5H8N2O5 HLKXYZVTANABHZ-REOHCLBHSA-N Hypoxanthine 1820 265 C5H4N4O FDGQSTZJBFJUBT-UHFFFAOYSA-N SHIKIMIC ACID 1834 204 C7H10O5 JXOHGGNKMLTUBP-HSUXUTPPSA-N ORNITHINE 1844 142 C5H12N2O2 AHLPHDHHMVZTML-BYPYZUCNSA-N CITRATE 1853 273 C6H8O7 KRKNYBCHXYNGOX-UHFFFAOYSA-N ARGININE 1872 174 C6H14N4O2 ODKSFYDXXFIFQN-BYPYZUCNSA-N Adenine 1875 264 C5H4N5 MOSFIJXAXDLOML-UHFFFAOYSA-N FRUCTOSE 1915 217 C6H12O6 LKDRXBCSQODPBY-VRPWFDPXSA-N MANNOSE 1929 174 C6H12O6 WQZGKKKJIJFFOK-QTVWNMPRSA-N Tyramine 1934 174 C8H11NO DZGWFCGJZKJUFP-UHFFFAOYSA-N GALACTOSE 1935 319 C6H12O6 WQZGKKKJIJFFOK-SVZMEOIVSA-N GLUCOSE 1941 319 C6H12O6 WQZGKKKJIJFFOK-GASJEMHNSA-N LYSINE 1947 174 C6H14N2O2 KDXKERNSBIXSRK-YFKPBYRVSA-N Tyrosine 1957 218 C9H11NO3 OUYCCCASQSFEME-UHFFFAOYSA-N Mannitol 1969 319 C6H14O6 FBPFZTCFMRRESA-KVTDHHQDSA-N IDITOL 1982 319 C6H14O6 FBPFZTCFMRRESA-ZXXMMSQZSA-N Pantothenate 2013 291 C9H17NO5 GHOKWGTUZJEAQD-ZETCQYMHSA-N DEOXYURIDINE-3-PHOSPHATE 2021 204 C9H15N2O14P3 AHCYMLUZIRLXAA-SHYZEUOFSA-N Gluconic acid 2044 333 C6H12O7 RGHNJXZEOKUKBD-SQOUGZDYSA-N N-Acetyl-D-glucosamine 2065 73 C8H15NO6 OVRNDRQMDRJTHS-RTRLPJTCSA-N Dopamine 2074 174 C8H11NO2 VYFYYTLLBUKUHU-UHFFFAOYSA-N MYO-INOSITOL 2128 305 C6H12O6 CDAISMWEOUEBRE-UHFFFAOYSA-N Guanine 2145 352 C5H5N5O UYTPUPDQBNUYGX-UHFFFAOYSA-N RIBULOSE-5-PHOSPHATE 2153 357 C5H11O8P FNZLKVNUWIIPSJ-UHNVWZDZSA-N XYLULOSE-5-PHOSPHATE 2172 357 C5H11O8P FNZLKVNUWIIPSJ-RFZPGFLSSA-N 6-METHYLINDOLE 2167 130 C9H8N MOSFIJXAXDLOML-UHFFFAOYSA-N MANNOHEPTULOSE 2163 319 C7H14O7 HSNZZMHEPUFJNZ-QMTIVRBISA-N Elaidic acid 2227 117 C18H34O2 ZQPPMHVWECSIRJ-MDZDMXLPSA-N TRYPTOPHAN 2251 202 C11H12N2O2 QIVBCDIJIAJPQS-VIFPVBQESA-N FRUCTOSE-6-PHOSPHATE 2371 315 C6H13O9P GSXOAOHZAIYLCY-HSUXUTPPSA-N 2-Deoxyuridine 2375 103 C9H12N2O5 MXHRCPNRJAMMIM-SHYZEUOFSA-N GLUCOSE-6-PHOSPHATE 2384 387 C6H13O9P NBSCHQHZLSJFNQ-GASJEMHNSA-N Sorbitol 6-phosphate 2422 387 C6H15O9P GACTWZZMVMUKNG-SLPGGIOYSA-N Uridine 2479 217 C9H12N2O6 DRTQHJPVMGBUCF-XVFCMESISA-N N-Acetyl glucosamine 6-phosphate 2540 357 C8H16NO9P BRGMHAYQAZFZDJ-RTRLPJTCSA-N Adenosine 2630 230 C10H13N5O4 OIRDTQYFTABQOQ-KQYNXXCUSA-N MALTOSE 2706 73 C12H22O11 GUBGYTABKSRVRQ-QUYVBRFLSA-N Trehalose 2714 191 C12H22O11 HDTRYLNUVZCQOY-LIZSDCNHSA-N SUCROSE 2699 361 C12H22O11 CZMRCDWAGMRECN-UGDNZRGBSA-N CELLOBIOSE 2779 204 C12H22O11 GUBGYTABKSRVRQ-QRZGKKJRSA-N Lactitol 2849 204 C12H24O11 VQHSOMBJVWLPSR-JVCRWLNRSA-N Sucrose-6-phosphate 2982 315 C12H23O14P WQQSIXKPRAUZJL-UGDNZRGBSA-N