SynCED ID Name
CAS Number
FormulaStructureSources
CHEM003380Malonyl-CoA
CAS524-14-1
C24H38N7O19P3S
Avg mass853.580
FooDB ChemicalsT3DB toxins
CHEM0033823-Hydroxyvaleric acid
CAS10237-77-1
C5H10O3
Avg mass118.131
FooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineT3DB toxins
CHEM0033843-Methyl-2-oxovaleric acid
CAS1460-34-0
C6H10O3
Avg mass130.142
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineT3DB toxins
CHEM003385Alpha-ketoisovaleric acid
CAS759-05-7
C5H8O3
Avg mass116.115
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineT3DB toxins
CHEM003386Ketoleucine
CAS816-66-0
C6H10O3
Avg mass130.142
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineT3DB toxins
CHEM0033873-O-Sulfogalactosylceramide (d18:1/24:0)
CAS151122-71-3
C48H93NO11S
Avg mass892.317
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxins
CHEM0033882-Methylcitric acid
CAS6061-96-7
C7H10O7
Avg mass206.150
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxins
CHEM003390Deoxyuridine triphosphate
CAS1173-82-6
C9H15N2O14P3
Avg mass468.142
FooDB ChemicalsT3DB toxins
CHEM003391Deoxyuridine
CAS951-78-0
C9H12N2O5
Avg mass228.202
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxins
CHEM003392Thymidine
CAS50-89-5
C10H14N2O5
Avg mass242.229
FooDB ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM003393Taurine
CAS107-35-7
C2H7NO3S
Avg mass125.147
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM003394S-Sulfocysteine
CAS1637-71-4
C3H6NO5S2
Avg mass200.214
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxins
CHEM003395Tyramine
CAS51-67-2
C8H11NO
Avg mass137.179
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM003396Carbamoyl phosphate
CAS590-55-6
CH4NO5P
Avg mass141.020
FooDB ChemicalsT3DB toxins
CHEM003397Phenylpyruvic acid
CAS156-06-9
C9H8O3
Avg mass164.158
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM003398Coproporphyrinogen III
CAS2624-63-7
C36H44N4O8
Avg mass660.757
FooDB ChemicalsHPV EPA ChemicalsT3DB toxins
CHEM003400Protoporphyrin IX
CAS553-12-8
C34H34N4O4
Avg mass562.658
FooDB ChemicalsT3DB toxins
CHEM003401Coproporphyrin I
CAS531-14-6
C36H38N4O8
Avg mass654.709
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxins
CHEM003402Glyoxylic acid
CAS298-12-4
C2H2O3
Avg mass74.036
FooDB ChemicalsHMDB Contaminants - UrineHPV EPA ChemicalsOECD HPV ChemicalsSTOFF IDENT CompoundsT3DB toxins
CHEM003403Propionylcarnitine
CAS17298-37-2
C10H19NO4
Avg mass217.262
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxins
CHEM003404Propionic acid
CAS79-09-4
C3H6O2
Avg mass74.079
Clean Air Act ChemicalsEAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineHPV EPA ChemicalsOECD HPV ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM003407Propionyl-CoA
CAS317-66-8
C24H40N7O17P3S
Avg mass823.597
FooDB ChemicalsT3DB toxins
CHEM003408dGTP
CAS2564-35-4
C10H16N5O13P3
Avg mass507.181
FooDB ChemicalsT3DB toxins
CHEM003409Guanosine
CAS118-00-3
C10H13N5O5
Avg mass283.241
FooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM003410Inosine
CAS58-63-9
C10H12N4O5
Avg mass268.226
FooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals