Exact Mass: 231.028005
Exact Mass Matches: 231.028005
Found 325 metabolites which its exact mass value is equals to given mass value 231.028005,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(S)-2-acetamido-6-oxopimelic acid
(S)-2-acetamido-6-oxopimelic acid is an oxo dicarboxylic acid, a N-acyl-amino acid and a dicarboxylic fatty acid. It is functionally related to a (S)-2-amino-6-oxopimelic acid. It is a conjugate acid of a (S)-2-acetamido-6-oxopimelate(2-).
N2-Succinyl-L-glutamic acid 5-semialdehyde
N2-Succinyl-L-glutamic acid 5-semialdehyde is a substrate for Succinate semialdehyde dehydrogenase (mitochondrial) and Ornithine aminotransferase (mitochondrial). It can be found in Escherichia (UniProt). N2-Succinyl-L-glutamic acid 5-semialdehyde is a substrate for Succinate semialdehyde dehydrogenase (mitochondrial) and Ornithine aminotransferase (mitochondrial). [HMDB]
4-acetaminophen sulfate
Paracetamol sulfate, also known as paracetamol sulfuric acid or 4-acetaminophen sulfate, is classified as a phenylsulfate. Phenylsulfates are compounds containing a sulfuric acid group conjugated to a phenyl group. Paracetamol sulfate is considered a slightly soluble (in water), acidic compound. Paracetamol sulfate is a metabolite of paracetamol, a common drug used for the relief of pain as an antipyretic. After paracetamol is absorbed from the gastrointestinal tract, it forms paracetamol sulfate by conjugation with sulfuric acid. Paracetamol sulfate can be found in both plasma and urine (PMID: 15127815).
Benzeneacetamide-4-O-sulphate
Benzeneacetamide-4-O-sulphate is a conjugate of benzeneacetamide and sulphate.
HPAA sulfate
N-(2-Hydroxyphenyl)acetamide sulfate (HPAA sulfate) is a benzoxazinoid metabolite. It is a potential plasma biomarker of whole grain intake (PMID: 24812068).
2,5-Dioxopyrrolidin-1-yl 2-(acetylthio)acetate
Methaniazide
C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent
5-(3-Aminopropylphosphanyloxy)-2-(hydroxymethyl)pyran-4-one
D020011 - Protective Agents > D000975 - Antioxidants
indole-3-acetyl-glycine
Indole-3-acetyl-glycine is also known as iaa-gly. Indole-3-acetyl-glycine is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Indole-3-acetyl-glycine can be found in a number of food items such as pistachio, red rice, star anise, and redcurrant, which makes indole-3-acetyl-glycine a potential biomarker for the consumption of these food products.
5-hydroxy-5-(1H-indol-3-yl)imidazolidine-2,4-dione
C11H9N3O3 (231.06438839999998)
2-Carbamoyl-3-methoxy-1,4-naphthoquinone|Me ether,amide-3-Hydroxy-1,4-naphthoquinone-2-carbxylic acid
2-(2-(Chlorophenyl)amino)benzaldehyde
CONFIDENCE standard compound; INTERNAL_ID 2695 CONFIDENCE standard compound; INTERNAL_ID 8566 CONFIDENCE standard compound; INTERNAL_ID 4090
6-(trifluoromethyl)furo[2,3-b]pyridine-2-carboxylic acid
C9H4F3NO3 (231.01432699999998)
(S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID HYDROCHLORIDE
6-chlorobenzo[de]isoquinoline-1,3-dione
C12H6ClNO2 (231.00870460000002)
(5Z)-2-AMINO-5-[(4-HYDROXY-3,5-DITERT-BUTYL-PHENYL)METHYLIDENE]-1,3-THIAZOL-4-ONE
7-(Trifluoromethoxy)-1H-indole-2,3-dione
C9H4F3NO3 (231.01432699999998)
4-HYDROXY-2-(PHENYLAMINO)PYRIMIDINE-5-CARBOXYLIC ACID
C11H9N3O3 (231.06438839999998)
2-Chloro-N-(2-chloroethyl)-N-methyl-2-phenylethanamine
2-chloro-5-nitro-n-hydroxyethyl p-phenylenediamine
4-(2-methoxyethoxy)pyridine-2-carboximidamide,hydrochloride
5-(Trifluoromethyl)isatoic anhydride
C9H4F3NO3 (231.01432699999998)
3-chloro-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propanamide
1,3-dioxo-2-prop-2-enylisoindole-5-carboxylic acid
N-(4-FLUOROPHENYL)ANTHRANILIC ACID
C13H10FNO2 (231.06955320000003)
methyl 4-(3-fluoropyridin-2-yl)benzoate
C13H10FNO2 (231.06955320000003)
3-AMINO-3-(2,6-DIFLUORO-3-METHOXY-PHENYL)-PROPIONIC ACID
3-AMINO-3-(2,6-DIFLUORO-4-METHOXY-PHENYL)-PROPIONIC ACID
3-AMINO-3-(2-DIFLUOROMETHOXYPHENYL)-PROPIONIC ACID
3-AMINO-3-(4-DIFLUOROMETHOXY-PHENYL)-PROPIONIC ACID
Methyl 3-AMino-3-(3-hydroxyphenyl)propanoate Hydrochloride
7-(TRIFLUOROMETHYL)-1H-BENZO[D][1,3]OXAZINE-2,4-DIONE
C9H4F3NO3 (231.01432699999998)
7,9-dimethyl-1H-pyrido[2,3]thieno[2,4-d]pyrimidin-4-one
C11H9N3OS (231.04663039999997)
hydroxyamphetamine hydrobromide
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D009184 - Mydriatics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent
3-(4-Nitrophenyl)-5-(prop-1-en-2-yl)-1,2,4-oxadiazole
C11H9N3O3 (231.06438839999998)
methyl 4-bromo-2,5-dimethyl-1h-pyrrole-3-carboxylate
1-Benzyl-4-nitro-1H-imidazole-5-carbaldehyde
C11H9N3O3 (231.06438839999998)
5,7-DIMETHYL-2,3-DIHYDRO-1H-[1,4]DIAZEPINEPERCHLORATE
4-Bromo-2-(dimethylaminomethyl)-1-fluorobenzene
C9H11BrFN (231.00588379999996)
2-(chloromethyl)-3-ethylimidazo[4,5-c]pyridine,hydrochloride
3-HYDROXY-2-OXO-3-TRIFLUOROMETHYL-7-METHYLINDOLINE
7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine,hydrochloride
Ethanone,1-(3,4-dihydroxyphenyl)-2-(dimethylamino)-, hydrochloride (1:1)
Imidodicarbonimidicdiamide, N-(2-fluorophenyl)-, hydrochloride (1:1)
methyl 3-amino-3-(2-chloro-6-fluorophenyl)propanoate
6-chloro-3-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazine
7-(2-methylsulfanylpyrimidin-4-yl)-5H-imidazo[1,2-b]pyrazole
6-Chloro-2,4,5-pyrimidinetriamine dihydrochloride
C4H8Cl3N5 (230.98452580000003)
4-(2-THIENYLMETHYL)-1LAMBDA6,4-THIAZINANE-1,1-DIONE
C9H13NO2S2 (231.03876780000002)
(2-amino-4,5-dimethylthiophen-3-yl)-phenylmethanone
5-Nitro-2-trifluoromethylbenzimidazole
C8H4F3N3O2 (231.02555999999998)
(2S,3S)-3-Amino-2-Hydroxy-4-Phenylbutyric Acid Hydrochloride
4-Chloro-6-(dimethylamino)-3-quinolinecarbonitrile
2-amino-1-(2,5-dimethoxyphenyl)ethanone hydrochloride
3-(2-NITRO-BENZYL)-3H-IMIDAZOLE-4-CARBALDEHYDE
C11H9N3O3 (231.06438839999998)
3-(3-NITRO-BENZYL)-3H-IMIDAZOLE-4-CARBALDEHYDE
C11H9N3O3 (231.06438839999998)
3-(4-NITRO-BENZYL)-3H-IMIDAZOLE-4-CARBALDEHYDE
C11H9N3O3 (231.06438839999998)
3-benzyl-5-nitroimidazole-4-carbaldehyde
C11H9N3O3 (231.06438839999998)
6-CHLORO-4-OXO-3-PHENYL-1(4H)-PYRIDAZINECARBONITRILE
N-(2-FLUOROPHENYL)ANTHRANILIC ACID
C13H10FNO2 (231.06955320000003)
3-(DIMETHYLAMINO)-4-METHOXYBENZOIC ACID HYDROCHLORIDE
3-(Cyanomethyl)-5-methoxy-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
C11H9N3O3 (231.06438839999998)
1-CHLORO-5,6,7-TRIMETHYL-6H-PYRROLO[3,4-D]PYRIDAZINE HYDROCHLORIDE
2-imidazol-1-yl-1-(4-nitrophenyl)ethanone
C11H9N3O3 (231.06438839999998)
4-amino-5-nitro-2-(trifluoromethyl)benzonitrile
C8H4F3N3O2 (231.02555999999998)
6-AMINO-5-(CHLOROACETYL)-1-ETHYLPYRIMIDINE-2,4(1H,3H)-DIONE
Lorcaserin HCl
C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
5-BROMO-2-(2-METHOXYETHYLAMINO)PYRIMIDINE
C7H10BrN3O (231.00071899999998)
N-Ethyl-N-(5-formyl-furan-2-ylmethyl)-methanesulfonamide
(2s,3r)-3-amino-2-hydroxy-4-phenylbutyric acid hydrochloride
1-BENZYL-5-NITRO-1H-IMIDAZOLE-4-CARBALDEHYDE
C11H9N3O3 (231.06438839999998)
3,4-dihydroisoquinoline-2(1H)-sulfonyl chloride(SALTDATA: FREE)
6-(TRIFLUOROMETHOXY)-1H-INDOLE-2,3-DIONE
C9H4F3NO3 (231.01432699999998)
2,4(1H,3H)-Pyrimidinedione,6-amino-5-(2-chloroacetyl)-1,3-dimethyl-
Sulfathiourea
C7H9N3O2S2 (231.01361740000002)
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01E - Sulfonamides and trimethoprim > J01EB - Short-acting sulfonamides C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
Methyl 5-chloro-2-hydroxy-3-nitrobenzoate
C8H6ClNO5 (230.99344960000002)
6-CHLORO-4-ETHYL-1,2,3,4-TETRAHYDROISOQUINOLINEHYDROCHLORIDE
3-(4-FORMYL-3-THIEN-2-YL-1H-PYRAZOL-1-YL)PROPANENITRILE
C11H9N3OS (231.04663039999997)
1-(Furan-2-ylmethyl)pyrrolidine-2-carboxylic acid hydrochloride
4-hydroxy-5-nitro-2-propylsulfanyl-1H-pyrimidin-6-one
2-[5-(ethoxycarbonylamino)-1,2,4-thiadiazol-3-yl]acetic acid
5,6-Difluoro-4-(trimethylsilyl)pyridine-2-carboxylic acid
Piperidin-4-yl(thiophen-2-yl)methanone hydrochloride
BENZENEMETHANAMINE, 2-BROMO-4-FLUORO-N,N-DIMETHYL-
C9H11BrFN (231.00588379999996)
tert-butyl N-(5-chloro-2-methylpyrazol-3-yl)carbamate
methyl 4-(aminocarbonyl)-5-(methylthio)thiophene-2-carboxylate
C8H9NO3S2 (231.00238439999998)
Methyl 4-amino-4,5,6,7-tetrahydrobenzofuran-3-carboxylate hydrochloride
2-(2,4-DIMETHOXYPHENYL)-2-OXOETHANAMINIUM CHLORIDE
Methanesulfonamide,N-(3-acetyl-4-fluorophenyl)-
C9H10FNO3S (231.03654020000002)
BENZENEMETHANAMINE, 4-BROMO-2-FLUORO-N,N-DIMETHYL-
C9H11BrFN (231.00588379999996)
5-ACETOACETYLAMINOBENZOIMIDAZOLONE
C11H9N3O3 (231.06438839999998)
2-(3,4-DIMETHOXY-PHENYL)-2-OXO-ETHYL-AMMONIUM, CHLORIDE
2-(2-Oxotetrahydrofuran-3-yl)-1H-isoindole-1,3(2H)-dione
3-(5-nitropyridin-2-yloxy)-2-methylpyridine
C11H9N3O3 (231.06438839999998)
n-(3-fluorophenyl)anthranilic acid
C13H10FNO2 (231.06955320000003)
5-Bromo-4-(dimethylamino)-2-methoxypyrimidine
C7H10BrN3O (231.00071899999998)
5-(3-METHYL-1H-INDAZOL-5-YL)-1,3,4-THIADIAZOL-2-AMINE
2-(chloromethyl)-3-(trifluoromethyl)pyridine hydrochloride
3-HYDROXY-2-OXO-3-TRIFLUOROMETHYL-6-METHYLINDOLINE
4-(4-Fluorobenzoyl)-1-methyl-1H-pyrrole-2-carbaldehyde
C13H10FNO2 (231.06955320000003)
5-Bromo-4-methoxy-N,N-dimethyl-2-pyrimidinamine
C7H10BrN3O (231.00071899999998)
Benzenamine, N,N-bis(2-chloroethyl)-3-methyl- (9CI)
8-ACETYL-7-METHYL-6H-1,2,5-OXADIAZOLO[3,4-E]INDOL-6-OL
C11H9N3O3 (231.06438839999998)
1H-pyrazole-1-acetamide, 4-bromo-3,5-dimethyl-
C7H10BrN3O (231.00071899999998)
2-(4-Methoxyphenyl)-5-nitropyrimidine
C11H9N3O3 (231.06438839999998)
methaniazide
C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent
(5-Hydroxy-4,6-dimethylpyridin-3-yl)methyl phosphate
D018977 - Micronutrients > D014815 - Vitamins
Nalidixic acid anion
A monocarboxylic acid anion that is the conjugate base of nalidixic acid; major species at pH 7.3.
2-Hydroxy-7-methoxy-5-methyl-1-naphthoate
A member of the class of naphthoates that is 1-naphthoate substituted at positions 2, 5 and 7 by hydroxy, methyl and methoxy groups respectively; major species at pH 7.3.
4-Methyl-2-[(5-methyl-2-thiophenyl)methylideneamino]phenol
1-(2-Hydroxyethyl)chromeno[3,4-d]triazol-4-one
C11H9N3O3 (231.06438839999998)
5-Hydroxyxanthotoxin(1-)
A phenolate anion that is the conjugate base of 5-hydroxyxanthotoxin, obtained by deprotonation of the hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
3-(2-chlorophenyl)-1-(1H-pyrrol-2-yl)-2-propen-1-one
2-Amino-3-(2-chloro-3,4-dihydroxyphenyl)propanoic acid
4,5-Dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxaldehyde
C12H11N2OS+ (231.05920559999998)
(3E)-5-methyl-3-[(N-methylanilino)methylidene]thiophen-2-one
(1-oxo-3a,4,7,7a-tetrahydro-1H-isoindol-3-yl)oxidanesulfonic acid
[(2R,3S,4S)-2,3,4,5-tetrahydroxypentyl] hydrogen phosphate
2-Amino-3-(2-chloro-4,5-dihydroxyphenyl)propanoic acid
2-Amino-3-(3-chloro-4,5-dihydroxyphenyl)propanoic acid
Paracetamol sulfate
An aryl sulfate that is paracetamol in which the hydroxy group has been replaced by a sulfooxy group.
N-succinyl-L-glutamic 5-semialdehyde
A dicarboxylic acid monoamide obtained by the formal condensation of amino group of L-glutamic 5-semialdehyde with one of the carboxy groups of succinic acid.