SynCED ID Name
CAS Number
FormulaStructureSources
CHEM002218Pyridostigmine
CAS155-97-5
C9H13N2O2
Avg mass181.212
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002219Pentostatin
CAS53910-25-1
C11H16N4O4
Avg mass268.269
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002220Hydroxyzine
CAS68-88-2
C21H27ClN2O2
Avg mass374.904
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002221Benzthiazide
CAS91-33-8
C15H14ClN3O4S3
Avg mass431.937
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002222Carbamazepine
CAS298-46-4
C15H12N2O
Avg mass236.269
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsSuspected Compounds - Waste WaterSuspected Compounds – Schymanski ProjectT3DB toxinsToxCast & Tox21 Chemicals
CHEM002223Clonidine
CAS4205-90-7
C9H9Cl2N3
Avg mass230.094
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002224Mazindol
CAS22232-71-9
C16H13ClN2O
Avg mass284.740
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002225L-Carnitine
CAS541-15-1
C7H15NO3
Avg mass161.199
Cosmetic ChemicalsEAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002226Ethosuximide
CAS77-67-8
C7H11NO2
Avg mass141.168
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002227Thiopental
CAS76-75-5
C11H18N2O2S
Avg mass242.338
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsSuspected Compounds - Waste WaterSuspected Compounds – Schymanski ProjectT3DB toxins
CHEM002228Cisapride
CAS81098-60-4
C23H29ClFN3O4
Avg mass465.945
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002229Butorphanol
CAS42408-82-2
C21H29NO2
Avg mass327.461
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002230Rifabutin
CAS72559-06-9
C46H62N4O11
Avg mass847.005
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002231Paramethadione
CAS115-67-3
C7H11NO3
Avg mass157.167
HMDB Contaminants - UrineT3DB toxins
CHEM002232Fluphenazine
CAS69-23-8
C22H26F3N3OS
Avg mass437.522
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002233Nicotinic acid
CAS59-67-6
C6H5NO2
Avg mass123.109
Cosmetic ChemicalsEAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHMDB Contaminants - UrineHPV EPA ChemicalsOECD HPV ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002234Clorazepate
CAS23887-31-2
C16H11ClN2O3
Avg mass314.723
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002235Astemizole
CAS68844-77-9
C28H31FN4O
Avg mass458.570
EAFUS ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002236Nystatin
CAS1400-61-9
C47H75NO17
Avg mass926.107
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002237Propoxyphene
CAS469-62-5
C22H29NO2
Avg mass339.479
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002238Pteroyl-D-glutamic acid
CAS1492-18-8
C20H23N7O7
Avg mass473.439
FooDB ChemicalsSTOFF IDENT CompoundsT3DB toxins
CHEM002239Pentazocine
CAS359-83-1
C19H27NO
Avg mass285.424
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002240Magnesium Sulfate
CAS7487-88-9
MgO4S
Avg mass120.368
EAFUS ChemicalsHMDB Contaminants - UrineHPV EPA ChemicalsOECD HPV ChemicalsT3DB toxins
CHEM002241Trazodone
CAS19794-93-5
C19H22ClN5O
Avg mass371.864
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002242Acamprosate
CAS77337-76-9
C5H11NO4S
Avg mass181.210
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins