SynCED ID Name
CAS Number
FormulaStructureSources
CHEM002062Vindesine
CAS53643-48-4
C43H55N5O7
Avg mass753.926
HMDB Contaminants - UrineT3DB toxins
CHEM002063Amitriptyline
CAS50-48-6
C20H23N
Avg mass277.403
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsT3DB toxins
CHEM002064Dapsone
CAS80-08-0
C12H12N2O2S
Avg mass248.301
HMDB Contaminants - UrineHPV EPA ChemicalsIARC Carcinogens Group 3STOFF IDENT CompoundsSuspected CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002065Glipizide
CAS29094-61-9
C21H27N5O4S
Avg mass445.535
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002066Tetrodotoxin
CAS4368-28-9
C11H17N3O8
Avg mass319.268
T3DB toxins
CHEM002067Methotrexate
CAS59-05-2
C20H22N8O5
Avg mass454.439
HMDB Contaminants - UrineIARC Carcinogens Group 3STOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002068Philanthotoxin
CAS77108-00-0
C23H41N5O3
Avg mass435.603
T3DB toxins
CHEM002069Batrachotoxin
CAS23509-16-2
C31H42N2O6
Avg mass538.675
T3DB toxins
CHEM002070Histrionicotoxin
CAS34272-51-0
C19H25NO
Avg mass283.415
T3DB toxins
CHEM002071Pumiliotoxin
CAS73376-35-9
C16H29NO
Avg mass251.414
T3DB toxins
CHEM002072Epibatidine
CAS140111-52-0
C11H13ClN2
Avg mass208.687
T3DB toxins
CHEM002073Allopumiliotoxin
CAS73376-38-2
C16H29NO2
Avg mass267.413
T3DB toxins
CHEM002074Arenobufagin
CAS464-74-4
C24H32O6
Avg mass416.507
T3DB toxins
CHEM002075Bufotenin
CAS487-93-4
C12H16N2O
Avg mass204.268
STOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002076Cinobufagin
CAS470-37-1
C26H34O6
Avg mass442.545
T3DB toxins
CHEM002077Marinobufagenin
CAS470-42-8
C24H32O5
Avg mass400.508
T3DB toxins
CHEM002078Onchidal
CAS67656-42-2
C17H24O3
Avg mass276.376
T3DB toxins
CHEM002079Saxitoxin
CAS35523-89-8
C10H17N7O4
Avg mass299.287
FooDB ChemicalsSTOFF IDENT CompoundsT3DB toxins
CHEM0020804-Aminopyridine
CAS504-24-5
C5H6N2
Avg mass94.115
Clean Air Act ChemicalsHPV EPA ChemicalsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002081Baclofen
CAS1134-47-0
C10H12ClNO2
Avg mass213.661
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002082Quetiapine
CAS111974-69-7
C21H25N3O2S
Avg mass383.507
FooDB ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002083Flecainide
CAS54143-55-4
C17H20F6N2O3
Avg mass414.343
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002084Disulfiram
CAS97-77-8
C10H20N2S4
Avg mass296.539
HMDB Contaminants - UrineHPV EPA ChemicalsIARC Carcinogens Group 3STOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002085Valproic acid
CAS99-66-1
C8H16O2
Avg mass144.211
FooDB ChemicalsSTOFF IDENT CompoundsSuspected CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002086Amantadine
CAS768-94-5
C10H17N
Avg mass151.249
EAFUS ChemicalsHMDB Contaminants - UrineHPV EPA ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals