Exact Mass: 189.0031

Exact Mass Matches: 189.0031

Found 116 metabolites which its exact mass value is equals to given mass value 189.0031, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

2-Pyridyl hydroxymethane sulfonic acid

2-Pyridyl hydroxymethane sulfonic acid

C6H7NO4S (189.0096)


   

Lanthionine ketimine

3,6-dihydro-2H-1,4-thiazine-3,5-dicarboxylic acid

C6H7NO4S (189.0096)


Lanthionine ketimine binds specifically and with high affinity to brain membranes and belong to a class of endogenous sulfur-containing cyclic products provided with a possible neurochemical function (PMID 1761027) [HMDB] Lanthionine ketimine binds specifically and with high affinity to brain membranes and belong to a class of endogenous sulfur-containing cyclic products provided with a possible neurochemical function (PMID 1761027).

   

2-aminophenol sulphate

Sulphuric acid mono-(2-aminophenyl ester)

C6H7NO4S (189.0096)


2-aminophenol sulphate is a metabolite found in urine of individuals that have consumed whole grains. It is a particularly strong biomarker for whole grain rye bread consumption (PMID: 23307617).

   

1-(2,3-Dichlorophenyl)ethanamine

2,3-Dichloro-alpha-methylbenzylamine, hydrochloride, (+-)-isomer

C8H9Cl2N (189.0112)


   

cyclic- 3,4-O-oxalyl-L-threonate

2-(5,6-Dioxo-1,4-dioxan-2-yl)-2-hydroxyacetic acid

C6H5O7 (189.0035)


Cyclic- 3,4-o-oxalyl-l-threonate, also known as 3,4-cyclic oxalyl theronolactone, belongs to tricarboxylic acids and derivatives class of compounds. Those are carboxylic acids containing exactly three carboxyl groups. Cyclic- 3,4-o-oxalyl-l-threonate is soluble (in water) and a moderately acidic compound (based on its pKa). Cyclic- 3,4-o-oxalyl-l-threonate can be found in a number of food items such as pot marjoram, arrowhead, naranjilla, and corn salad, which makes cyclic- 3,4-o-oxalyl-l-threonate a potential biomarker for the consumption of these food products.

   

cyclic-2,3-O-oxalyl-L-threonate

3-(Hydroxymethyl)-5,6-dioxo-1,4-dioxane-2-carboxylic acid

C6H5O7- (189.0035)


Cyclic-2,3-o-oxalyl-l-threonate, also known as 2,3-cyclic oxalyl theronolactone, belongs to tricarboxylic acids and derivatives class of compounds. Those are carboxylic acids containing exactly three carboxyl groups. Cyclic-2,3-o-oxalyl-l-threonate is soluble (in water) and a moderately acidic compound (based on its pKa). Cyclic-2,3-o-oxalyl-l-threonate can be found in a number of food items such as mustard spinach, ostrich fern, fennel, and malus (crab apple), which makes cyclic-2,3-o-oxalyl-l-threonate a potential biomarker for the consumption of these food products.

   

D-threo-isocitrate

1-Hydroxypropane-1,2,3-tricarboxylate

C6H5O7 (189.0035)


D-threo-isocitrate, also known as isocitric acid or 1-hydroxytricarballylate, belongs to tricarboxylic acids and derivatives class of compounds. Those are carboxylic acids containing exactly three carboxyl groups. D-threo-isocitrate is soluble (in water) and a weakly acidic compound (based on its pKa). D-threo-isocitrate can be found in a number of food items such as sunflower, endive, mulberry, and chickpea, which makes D-threo-isocitrate a potential biomarker for the consumption of these food products.

   

Lanthionine ketimine

Lanthionine ketimine

C6H7NO4S (189.0096)


A member of the class of 1,4-thiazines that is 3,6-dihydro-2H-1,4-thiazine substituted by carboxy groups at positions 3 and 5. It is a natural but non-proteogenic amino acid found in human urine and brain.

   

1H-Imidazole-4-carboxylicacid,2-amino-5-(chlorocarbonyl)-(9CI)

1H-Imidazole-4-carboxylicacid,2-amino-5-(chlorocarbonyl)-(9CI)

C5H4ClN3O3 (188.9941)


   

3,4-Dihydro-2H-1,4-thiazine-3,5-dicarboxylic acid

3,4-Dihydro-2H-1,4-thiazine-3,5-dicarboxylic acid

C6H7NO4S (189.0096)


   

1H-Imidazole, 1-(chloroacetyl)-4-nitro- (9CI)

1H-Imidazole, 1-(chloroacetyl)-4-nitro- (9CI)

C5H4ClN3O3 (188.9941)


   

2-nitrobenzoic acid sodium salt

2-nitrobenzoic acid sodium salt

C7H4NNaO4 (189.0038)


   

2-[(5-CHLORO-2-PYRIDYL)THIO]ETHAN-1-OL

2-[(5-CHLORO-2-PYRIDYL)THIO]ETHAN-1-OL

C7H8ClNOS (189.0015)


   

(2,6-DICHLORO-PHENYL)-ETHYL-AMINE

(2,6-DICHLORO-PHENYL)-ETHYL-AMINE

C8H9Cl2N (189.0112)


   

1-(2,5-Dichloro-Phenyl)-Ethylamine

1-(2,5-Dichloro-Phenyl)-Ethylamine

C8H9Cl2N (189.0112)


   

2,3-dichloro-N-ethylaniline

2,3-dichloro-N-ethylaniline

C8H9Cl2N (189.0112)


   

(2,4-Dichlorobenzyl)methylamine

(2,4-Dichlorobenzyl)methylamine

C8H9Cl2N (189.0112)


   

4-amino-2-methylsulfanyl-1,3-thiazole-5-carboxamide

4-amino-2-methylsulfanyl-1,3-thiazole-5-carboxamide

C5H7N3OS2 (189.0031)


   

(1S)-1-(3,5-Dichlorophenyl)ethanamine

(1S)-1-(3,5-Dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

2,3-dichloro-N,N-dimethylaniline

2,3-dichloro-N,N-dimethylaniline

C8H9Cl2N (189.0112)


   

1-chloro-4-fluoro-2-methyl-5-nitrobenzene

1-chloro-4-fluoro-2-methyl-5-nitrobenzene

C7H5ClFNO2 (188.9993)


   

3,5-dichloro-N-ethylaniline

3,5-dichloro-N-ethylaniline

C8H9Cl2N (189.0112)


   

2-(2,4-Dichlorophenyl)ethanamine

2-(2,4-Dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

4-Chloroquinazoline-6-carbonitrile

4-Chloroquinazoline-6-carbonitrile

C9H4ClN3 (189.0094)


   

1-chloro-5-fluoro-4-methyl-2-nitrobenzene

1-chloro-5-fluoro-4-methyl-2-nitrobenzene

C7H5ClFNO2 (188.9993)


   

(2,3-Dichlorobenzyl)methylamine

(2,3-Dichlorobenzyl)methylamine

C8H9Cl2N (189.0112)


   

1-(3,5-dichlorophenyl)-N-methylmethanamine

1-(3,5-dichlorophenyl)-N-methylmethanamine

C8H9Cl2N (189.0112)


   

4-propan-2-yl-1,3-thiazole-2-carbonyl chloride

4-propan-2-yl-1,3-thiazole-2-carbonyl chloride

C7H8ClNOS (189.0015)


   

2-(Chloromethyl)-1-fluoro-4-nitrobenzene

2-(Chloromethyl)-1-fluoro-4-nitrobenzene

C7H5ClFNO2 (188.9993)


   

5-Chloro-1-fluoro-2-methyl-3-nitrobenzene

5-Chloro-1-fluoro-2-methyl-3-nitrobenzene

C7H5ClFNO2 (188.9993)


   

1-(2,4-Dichlorophenyl)ethanamine

1-(2,4-Dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

2-CHLORO-4-METHOXY-5-NITRO-PYRIMIDINE

2-CHLORO-4-METHOXY-5-NITRO-PYRIMIDINE

C5H4ClN3O3 (188.9941)


   

n-(2,5-dichlorobenzyl)-n-methylamine

n-(2,5-dichlorobenzyl)-n-methylamine

C8H9Cl2N (189.0112)


   

Sodium 4-nitrobenzoate

Sodium 4-nitrobenzoate

C7H4NNaO4 (189.0038)


   

2-(3,5-dichlorophenyl)ethanamine

2-(3,5-dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

6-Chloro-2,3-dihydro-1H-indole hydrochloride

6-Chloro-2,3-dihydro-1H-indole hydrochloride

C8H9Cl2N (189.0112)


   

P-AMINOPHENOL SULFATE

P-AMINOPHENOL SULFATE

C6H7NO4S (189.0096)


   

6-chloro-2-methyl-5-nitropyrimidin-4-ol

6-chloro-2-methyl-5-nitropyrimidin-4-ol

C5H4ClN3O3 (188.9941)


   

Sodium 3-nitrobenzoate

Sodium 3-nitrobenzoate

C7H4NNaO4 (189.0038)


   

5-Chloroisoindoline

5-Chloroisoindoline

C8H9Cl2N (189.0112)


   

4-Chloroindoline hydrochloride

4-Chloroindoline hydrochloride

C8H9Cl2N (189.0112)


   

(4-CHLORO-2-METHYLPHENYL)METHYLCYANOCARBONIMIDODITHIOATE

(4-CHLORO-2-METHYLPHENYL)METHYLCYANOCARBONIMIDODITHIOATE

C6H8ClN3S (189.0127)


   

2-(3,4-Dichlorophenyl)ethanamine

2-(3,4-Dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

(2,4-dichloro-6-methylphenyl)methanamine

(2,4-dichloro-6-methylphenyl)methanamine

C8H9Cl2N (189.0112)


   

2-Chloro-4-fluoro-3-methyl-1-nitrobenzene

2-Chloro-4-fluoro-3-methyl-1-nitrobenzene

C7H5ClFNO2 (188.9993)


   

2,5-Dichloro-3,6-dimethylbenzenamine

2,5-Dichloro-3,6-dimethylbenzenamine

C8H9Cl2N (189.0112)


   

(3,4-DEHYDRO-PRO3)-TUFTSIN

(3,4-DEHYDRO-PRO3)-TUFTSIN

C8H9Cl2N (189.0112)


   

2,3-DICHLORO PHENETHYL AMINE

2,3-DICHLORO PHENETHYL AMINE

C8H9Cl2N (189.0112)


   

4-chloro-6-methoxy-5-nitro-pyrimidine

4-chloro-6-methoxy-5-nitro-pyrimidine

C5H4ClN3O3 (188.9941)


   

(S)-1-(3,4-DICHLOROPHENYL)ETHANAMINE

(S)-1-(3,4-DICHLOROPHENYL)ETHANAMINE

C8H9Cl2N (189.0112)


   

2-Amino-4-chloro-5-fluorobenzoic acid

2-Amino-4-chloro-5-fluorobenzoic acid

C7H5ClFNO2 (188.9993)


   

5-Chloroindoline hydrochloride

5-Chloroindoline hydrochloride

C8H9Cl2N (189.0112)


   

2-Amino-5-chloro-4-fluorobenzoic acid

2-Amino-5-chloro-4-fluorobenzoic acid

C7H5ClFNO2 (188.9993)


   

4-Chloroquinazoline-2-carbonitrile

4-Chloroquinazoline-2-carbonitrile

C9H4ClN3 (189.0094)


   

DIMETHYL 2-THIOCYANATOMALONATE

DIMETHYL 2-THIOCYANATOMALONATE

C6H7NO4S (189.0096)


   

(S)-2,6-Dichloro-a-methyl-benzenemethanamine

(S)-2,6-Dichloro-a-methyl-benzenemethanamine

C8H9Cl2N (189.0112)


   

(1R)-1-(3,4-dichlorophenyl)ethanamine

(1R)-1-(3,4-dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

4-Amino-3-hydroxybenzenesulfonic acid

4-Amino-3-hydroxybenzenesulfonic acid

C6H7NO4S (189.0096)


   

METHYL2-CHLORO-5-FLUORONICOTINATE

METHYL2-CHLORO-5-FLUORONICOTINATE

C7H5ClFNO2 (188.9993)


   

2-Methyl-6-Chloro-5-Nitro-4(1H)-Pyrimidinone

2-Methyl-6-Chloro-5-Nitro-4(1H)-Pyrimidinone

C5H4ClN3O3 (188.9941)


   

3-Chloro-4-fluoro-5-nitrotoluene

3-Chloro-4-fluoro-5-nitrotoluene

C7H5ClFNO2 (188.9993)


   

4-Amino-4,5-dihydro-6H-cyclopenta[b]thiophen-6-one hydrochloride

4-Amino-4,5-dihydro-6H-cyclopenta[b]thiophen-6-one hydrochloride

C7H8ClNOS (189.0015)


   

(1R)-1-(3,5-Dichlorophenyl)ethanamine

(1R)-1-(3,5-Dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

1H-Imidazole-5-carbonylchloride,1-methyl-4-nitro-(9CI)

1H-Imidazole-5-carbonylchloride,1-methyl-4-nitro-(9CI)

C5H4ClN3O3 (188.9941)


   

1-(2,5-Dichlorphenyl)ethanamin

1-(2,5-Dichlorphenyl)ethanamin

C8H9Cl2N (189.0112)


   

3-(2,4-Dioxo-thiazolidin-3-yl)-propionic acid

3-(2,4-Dioxo-thiazolidin-3-yl)-propionic acid

C6H7NO4S (189.0096)


   

2-Chloro-4-fluoro-5-nitrotoluene

2-Chloro-4-fluoro-5-nitrotoluene

C7H5ClFNO2 (188.9993)


   

4-Chloroisoindoline hydrochloride (1:1)

4-Chloroisoindoline hydrochloride (1:1)

C8H9Cl2N (189.0112)


   

2,6-DICHLOROPHENETHYL AMINE

2,6-DICHLOROPHENETHYL AMINE

C8H9Cl2N (189.0112)


   

1-(Chloromethyl)-2-fluoro-3-nitrobenzene

1-(Chloromethyl)-2-fluoro-3-nitrobenzene

C7H5ClFNO2 (188.9993)


   

1-Chloro-5-fluoro-2-methyl-3-nitrobenzene

1-Chloro-5-fluoro-2-methyl-3-nitrobenzene

C7H5ClFNO2 (188.9993)


   

4-amino-3-chloro-2-fluorobenzoic acid

4-amino-3-chloro-2-fluorobenzoic acid

C7H5ClFNO2 (188.9993)


   

1-Chloro-2-fluoro-4-methyl-5-nitrobenzene

1-Chloro-2-fluoro-4-methyl-5-nitrobenzene

C7H5ClFNO2 (188.9993)


   

2-Aminophenol-4-sulfonic acid

3-Amino-4-hydroxybenzenesulfonic acid

C6H7NO4S (189.0096)


   

thiophen-3-amine oxalate

thiophen-3-amine oxalate

C6H7NO4S (189.0096)


   

2-Chloro-5-fluoroisonicotinic acid methyl ester

2-Chloro-5-fluoroisonicotinic acid methyl ester

C7H5ClFNO2 (188.9993)


   

citrate synthase

citrate synthase

C6H5O7-3 (189.0035)


   

1-(3,4-Dichlorophenyl)-N-methylmethanamine

1-(3,4-Dichlorophenyl)-N-methylmethanamine

C8H9Cl2N (189.0112)


   

2,5-dichloro-N-ethylaniline

2,5-dichloro-N-ethylaniline

C8H9Cl2N (189.0112)


   

2,4-dichloro-3,5,6-trimethylpyridine

2,4-dichloro-3,5,6-trimethylpyridine

C8H9Cl2N (189.0112)


   

Cobaltocene

Cobaltocene

C10H10Co (189.0114)


   

3-Aminothiophene Oxalate

3-Aminothiophene Oxalate

C6H7NO4S (189.0096)


   

1-(3,4-Dichlorphenyl)ethanamin

1-(3,4-Dichlorphenyl)ethanamin

C8H9Cl2N (189.0112)


   

2-CHLORO-3-FLUOROISONICOTINIC ACID METHYL ESTER

2-CHLORO-3-FLUOROISONICOTINIC ACID METHYL ESTER

C7H5ClFNO2 (188.9993)


   

(1S)-1-(2,4-Dichlorophenyl)ethanamine

(1S)-1-(2,4-Dichlorophenyl)ethanamine

C8H9Cl2N (189.0112)


   

1-(Chloromethyl)-3-fluoro-5-nitrobenzene

1-(Chloromethyl)-3-fluoro-5-nitrobenzene

C7H5ClFNO2 (188.9993)


   

4-(Chloromethyl)-1-fluoro-2-nitrobenzene

4-(Chloromethyl)-1-fluoro-2-nitrobenzene

C7H5ClFNO2 (188.9993)


   

2-pyridylhydroxymethanesulfonic acid

2-pyridylhydroxymethanesulfonic acid

C6H7NO4S (189.0096)


   

(2,4-DICHLORO-PHENYL)-ETHYL-AMINE

(2,4-DICHLORO-PHENYL)-ETHYL-AMINE

C8H9Cl2N (189.0112)


   

5-Chloroisoindoline hydrochloride (1:1)

5-Chloroisoindoline hydrochloride (1:1)

C8H9Cl2N (189.0112)


   

Citrate

Citrate

C6H5O7-3 (189.0035)


D064449 - Sequestering Agents > D002614 - Chelating Agents > D065096 - Calcium Chelating Agents D006401 - Hematologic Agents > D000925 - Anticoagulants COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

cyclic- 3,4-O-oxalyl-L-threonate

2-(5,6-Dioxo-1,4-dioxan-2-yl)-2-hydroxyacetic acid

C6H5O7- (189.0035)


Cyclic- 3,4-o-oxalyl-l-threonate, also known as 3,4-cyclic oxalyl theronolactone, belongs to tricarboxylic acids and derivatives class of compounds. Those are carboxylic acids containing exactly three carboxyl groups. Cyclic- 3,4-o-oxalyl-l-threonate is soluble (in water) and a moderately acidic compound (based on its pKa). Cyclic- 3,4-o-oxalyl-l-threonate can be found in a number of food items such as pot marjoram, arrowhead, naranjilla, and corn salad, which makes cyclic- 3,4-o-oxalyl-l-threonate a potential biomarker for the consumption of these food products.

   

1-Hydroxypropane-1,2,3-tricarboxylate

1-Hydroxypropane-1,2,3-tricarboxylate

C6H5O7-3 (189.0035)


   

Threo-DS-isocitrate

Threo-DS-isocitrate

C6H5O7-3 (189.0035)


   

(1S,2S)-1-Hydroxypropane-1,2,3-tricarboxylate

(1S,2S)-1-Hydroxypropane-1,2,3-tricarboxylate

C6H5O7-3 (189.0035)


   

2-(Carboxylatomethoxy)butanedioate

2-(Carboxylatomethoxy)butanedioate

C6H5O7-3 (189.0035)


   

1-Carboxy-3-chloro-3,4-dihydroxycyclohexa-1,5-diene

1-Carboxy-3-chloro-3,4-dihydroxycyclohexa-1,5-diene

C7H6ClO4- (188.9955)


   

(3S,4S)-5-chloro-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylate

(3S,4S)-5-chloro-3,4-dihydroxycyclohexa-1,5-diene-1-carboxylate

C7H6ClO4- (188.9955)


   

3-Chloro-3,5-cyclohexadiene-l,2-diol-1-carboxylate

3-Chloro-3,5-cyclohexadiene-l,2-diol-1-carboxylate

C7H6ClO4- (188.9955)


   

5-Chloro-3,5-cyclohexadiene-l,2-diol-1-carboxylate

5-Chloro-3,5-cyclohexadiene-l,2-diol-1-carboxylate

C7H6ClO4- (188.9955)


   

(1S,2R)-1-hydroxypropane-1,2,3-tricarboxylate

(1S,2R)-1-hydroxypropane-1,2,3-tricarboxylate

C6H5O7-3 (189.0035)


   

2-(2-Chloro-4-methyl-5-oxofuran-2-yl)acetate

2-(2-Chloro-4-methyl-5-oxofuran-2-yl)acetate

C7H6ClO4- (188.9955)


   

L-erythro-isocitrate(3-)

L-erythro-isocitrate(3-)

C6H5O7-3 (189.0035)


   

2-Chloro-4-methyl-muconolactone

2-Chloro-4-methyl-muconolactone

C7H6ClO4- (188.9955)


   

5-Chloro-3-methyl-muconolactone

5-Chloro-3-methyl-muconolactone

C7H6ClO4- (188.9955)


   

(3R)-3,6-Dihydro-2H-1,4-thiazine-3,5-dicarboxylic acid

(3R)-3,6-Dihydro-2H-1,4-thiazine-3,5-dicarboxylic acid

C6H7NO4S (189.0096)


   

Cobalt, bis(eta5-2,4-cyclopentadien-1-yl)-

Cobalt, bis(eta5-2,4-cyclopentadien-1-yl)-

C10H10Co-6 (189.0114)


   

D-erythro-isocitrate(3-)

D-erythro-isocitrate(3-)

C6H5O7 (189.0035)


A isocitrate(3-) that is the conjugate base of D-erythro-isocitric acid.

   

L-threo-isocitrate(3-)

L-threo-isocitrate(3-)

C6H5O7 (189.0035)


An isocitrate(3-) that is the conjugate base of L-threo-isocitric acid.

   

2-Aminophenyl sulfate

2-Aminophenyl sulfate

C6H7NO4S (189.0096)


   

isocitrate(3-)

isocitrate(3-)

C6H5O7 (189.0035)


Propan-1-ol with a hydrogen at each of the 3 carbon positions substituted with a carboxylate group.

   

citrate(3-)

citrate(3-)

C6H5O7 (189.0035)


A tricarboxylic acid trianion, obtained by deprotonation of the three carboxy groups of citric acid.

   

L-erythro-isocitrate(3-)

L-erythro-isocitrate(3-)

C6H5O7 (189.0035)


An isocitrate(3-) that is the conjugate base of L-erythro-isocitric acid.

   

D-threo-isocitrate(3-)

D-threo-isocitrate(3-)

C6H5O7 (189.0035)


The D-threo-form of isocitrate(3-).

   

Pyridyl hydroxymethane sulfonic acid

Pyridyl hydroxymethane sulfonic acid

C6H7NO4S (189.0096)


   

Aminophenyl sulfate

Aminophenyl sulfate

C6H7NO4S (189.0096)