Exact Mass: 139.9602

Exact Mass Matches: 139.9602

Found 100 metabolites which its exact mass value is equals to given mass value 139.9602, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Phosphonoacetate

Disodium phosphonoacetate monohydrate

C2H5O5P (139.9875)


Phosphonoacetate, also known as fosfonet or phosphonacetic acid, belongs to the class of organic compounds known as organic phosphonic acids. These are organic compounds containing phosphonic acid. Phosphonoacetate exists in all living organisms, ranging from bacteria to humans. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AD - Phosphonic acid derivatives A simple organophosphorus compound that inhibits DNA polymerase, especially in viruses and is used as an antiviral agent. [HMDB] D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent KEIO_ID P082 Phosphonoacetic acid is an endogenous metabolite. Phosphonoacetic acid also has anti-orthopoxvirus activity[1].

   

Acetylphosphate

Acetic acid, monoanhydride with phosphoric acid

C2H5O5P (139.9875)


Acetylphosphate, also known as acetyl-p, belongs to the class of organic compounds known as acyl monophosphates. These are organic compounds containing a monophosphate linked to an acyl group. They have the general structure R-CO-P(O)(O)OH, R=H or organyl. Since acetylphosphate synthesis is known to depend on cholinesterase activity, pseudocholinesterase was assumed to participate to a small extent in acetylphosphate synthesis by cancerous serum. It is also an intermediate in pyruvate metabolism. Acetylphosphate is a drug. Acetylphosphate exists in all living organisms, ranging from bacteria to humans. Acetylphosphate can be converted into acetic acid; which is mediated by the enzyme acylphosphatase-1. It is generated from pyruvate and the formation is catalyzed by pyruvate oxidase (EC:1.2.3.3). In humans, acetylphosphate is involved in the metabolic disorder called the pyruvate dehydrogenase complex deficiency pathway. It is generated from sulfoacetaldehyde, converted to acetyl-CoA and acetate via phosphate acetyltransferase (EC:2.3.1.8) and acetate kinase (EC:2.7.2.1) respectively. Acetylphosphate or actyl phosphate is a compound involved in taurine and hypotaurine metabolism as well as pyruvate metabolism. Cancerous serum produced 37\\% less acetylphosphate than normal serum. Cancerous serum produced 37\\% less acetylphosphate than normal serum. Since acetylphosphate synthesis is known to depend on cholinesterase activity, pseudocholinesterase was assumed to participate to a small extent in acetylphosphate synthesis by cancerous serum.( Rev. sci. Med., Acad. rep. populaire Roumaine (1960), 5 7-10) [HMDB]

   

4-Chlorobenzaldehyde

4-Chlorobenzaldehyde

C7H5ClO (140.0029)


   

Methylarsonate

Monomethylarsonic acid, ammonium, iron (3+) salt

CH5AsO3 (139.9455)


Methylarsonate is used as a contact herbicide in either the monosodium or disodium salt form. It goes by the trade names Weed-E-Rad, Ansar 170 H.C., Ansar 529 H.C., DiTac and others. Methylarsonate is considered only slightly toxic, having an oral LD50 of 2200 mg/Kg for rats. The inhalation risk is greater with LD50 Rats >20 mg. Long term studies with people exposed to organoarsenicals has shown an increased risk of skin cancer (Spiewak, 2001), lung cancer and some liver cancers, although some recent studies have shown some arsenic containing compounds (specifically Arsine trioxide) may have anticarcinogenic properties (Wang, 2001). In mammals, Methylarsonate is also an intermediate in the detoxification of inorganic arsenic. In the arsenate detoxification I pathway, arsenite reacts with S-adenosyl-L-methionine to produce methylarsonate and S-adenosyl-L-homocysteine. Arsenite methyltransferase catalyzes this reaction. Methylarsonate then reacts with 2 glutathione molecules to produce glutathione disulfide and methylarsonite. This reaction is catalyzed by methylarsonate reductase. Methylarsonate is an organic arsenic compound with adverse effects similar to those of arsenic trioxide. Arsenic is found in the environment primarily as arsenate and arsenite species. Arsenate is reduced to arsenite by arsenate reductase and can be subsequently methylated to Methylarsonate. This is then reduced and methylated to Dimethylarsinate, which can excreted and is considerably less toxic to the organism than any of the previous intermediate compounds. Methylarsonate was formerly included in some vitamin and mineral preparations. It was once used to treat tuberculosis, chorea, and other affections in which the cacodylates were used. Methylarsonate is used as a contact herbicide in either the monosodium or disodium salt form. It goes by the trade names Weed-E-Rad, Ansar 170 H.C., Ansar 529 H.C., DiTac and others. Methylarsonate is considered only slightly toxic, having an oral LD50 of 2200 mg/Kg for rats. The inhalation risk is greater with LD50 Rats >20 mg. Long term studies with people exposed to organoarsenicals has shown an increased risk of skin cancer (Spiewak, 2001), lung cancer and some liver cancers, although some recent studies have shown some arsenic containing compounds (specifically Arsine trioxide) may have anticarcinogenic properties (Wang, 2001). In mammals, Methylarsonate is also an intermediate in the detoxification of inorganic arsenic. D010575 - Pesticides > D006540 - Herbicides D009676 - Noxae > D013723 - Teratogens D016573 - Agrochemicals

   

Sulfoacetic acid

2-Sulphoacetic acid

C2H4O5S (139.9779)


   

Benzoyl chloride

Benzenecarbonyl chloride

C7H5ClO (140.0029)


   

Glycolaldehyde phosphate

Glycolaldehyde phosphate

C2H5O5P (139.9875)


   

Methyl (methylthio)methyl disulfide

(Methyldisulphanyl)(methylsulphanyl)methane

C3H8S3 (139.9788)


Methyl (methylthio)methyl disulfide is found in brassicas. Methyl (methylthio)methyl disulfide is found in essential oil of hops and in Camembert cheeses, cooked cabbage, broccoli and cauliflowe Found in essential oil of hops and in Camembert cheeses, cooked cabbage, broccoli and cauliflower

   

Liquid thiophthene

thieno[2,3-b]thiophene

C6H4S2 (139.9754)


Liquid thiophthene is a maillard produc

   

Ethyl methyl trisulfide

1-Ethyl-3-methyltrisulphane

C3H8S3 (139.9788)


Ethyl methyl trisulfide is found in animal foods. Ethyl methyl trisulfide is found in durian fruit, cooked beef, crucifers, pork, Chinese chive (Allium tuberosum), Rakkyo (Allium chinense), coffee and roasted peanut aroma. Ethyl methyl trisulfide is a flavouring for meat products. Found in durian fruit, cooked beef, crucifers, pork, Chinese chive (Allium tuberosum), Rakkyo (Allium chinense), coffee and roasted peanut aroma. Flavouring for meat products

   

thioquinone

2-Sulphanylcyclohexa-2,5-diene-1,4-dione

C6H4O2S (139.9932)


   

Magnesium silicate (Mg2SiO4)

dimagnesium(2+) ion orthosilicate

Mg2O4Si (139.9267)


Anticaking and coating agent

   

3-chlorobenzaldehyde

3-Chlorobenzaldehyde

C7H5ClO (140.0029)


3-chlorobenzaldehyde belongs to benzoyl derivatives class of compounds. Those are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). 3-chlorobenzaldehyde is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 3-chlorobenzaldehyde can be found in a number of food items such as calabash, black raspberry, ginger, and tartary buckwheat, which makes 3-chlorobenzaldehyde a potential biomarker for the consumption of these food products.

   

2,3-dichloroprop-2-enoic acid

2,3-dichloroprop-2-enoic acid

C3H2Cl2O2 (139.9432)


   

1,2,4-trithiolane 4-oxide

1,2,4-trithiolane 4-oxide

C2H4OS3 (139.9424)


   

methylsulfanyl(methylsulfonyl)methane

methylsulfanyl(methylsulfonyl)methane

C3H8O2S2 (139.9966)


   

3,3-dichloroacrylic acid

3,3-dichloro-2-propenoic acid

C3H2Cl2O2 (139.9432)


   

Cyclopentanepentone

Cyclopentanepentone

C5O5 (139.9746)


   

1,2,4-Trithiolane 1-oxide

1,2,4-Trithiolane 1-oxide

C2H4OS3 (139.9424)


   

Malonyl chloride

Malonyl chloride

C3H2Cl2O2 (139.9432)


   

acetylphosphate

acetyl dihydrogen phosphate

C2H5O5P (139.9875)


   

Phosphonoacetate

Acetic acid,2-phosphono-

C2H5O5P (139.9875)


Phosphonoacetic acid is an endogenous metabolite. Phosphonoacetic acid also has anti-orthopoxvirus activity[1].

   

Phosphonoacetic acid

Acetic acid,2-phosphono-

C2H5O5P (139.9875)


J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AD - Phosphonic acid derivatives D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent Phosphonoacetic acid is an endogenous metabolite. Phosphonoacetic acid also has anti-orthopoxvirus activity[1].

   

Acetyl phosphate

Acetyl phosphate

C2H5O5P (139.9875)


   

Liquid thiophthene

thieno[2,3-b]thiophene

C6H4S2 (139.9754)


   

nistc42474442

(Methyldisulfanyl)(methylsulfanyl)methane

C3H8S3 (139.9788)


   

Dimethyl trisulfide

1-ethyl-3-methyltrisulfane

C3H8S3 (139.9788)


   

2,3-dichloro-2Z-propenoic acid

2,3-dichloro-2Z-propenoic acid

C3H2Cl2O2 (139.9432)


   

Vinyl Trifluoroacetate

Vinyl Trifluoroacetate

C4H3F3O2 (140.0085)


   

2-(Trifluoromethyl)acrylic acid

2-(Trifluoromethyl)acrylic acid

C4H3F3O2 (140.0085)


   

1,4-dichlorobutan-2-one

1,4-dichlorobutan-2-one

C4H6Cl2O (139.9796)


   

3-Chlorothietane-1,1-dioxide

3-Chlorothietane-1,1-dioxide

C3H5ClO2S (139.9699)


   

Dichloro(methyl)vinylsilane

Dichloro(methyl)vinylsilane

C3H6Cl2Si (139.9616)


   

Sodium Perchlorate Monohydrate

Sodium Perchlorate Monohydrate

ClH2NaO5 (139.9488)


   

3-Chlorobenzaldehyde

3-Chlorobenzaldehyde

C7H5ClO (140.0029)


   

2-Chlorobenzaldehyde

2-Chlorobenzaldehyde

C7H5ClO (140.0029)


   

tert-Butylsulfinyl chloride

tert-Butylsulfinyl chloride

C4H9ClOS (140.0063)


   

Magnesium thiocyanate

Magnesium thiocyanate

C2MgN2S2 (139.9353)


   

5-Methyl-3-isoxazolyl isothiocyanate

5-Methyl-3-isoxazolyl isothiocyanate

C5H4N2OS (140.0044)


   

4-Pyrimidinecarboxaldehyde, 1,2-dihydro-2-thioxo- (9CI)

4-Pyrimidinecarboxaldehyde, 1,2-dihydro-2-thioxo- (9CI)

C5H4N2OS (140.0044)


   

4,4,4-trifluoro crotonic acid

4,4,4-trifluoro crotonic acid

C4H3F3O2 (140.0085)


   

Iron Boride

Iron Boride

B2Fe2H6 (139.9354)


   

hydrobromic acid

hydrobromic acid

C2H5BrO2 (139.9473)


   

4-Chlorobutyryl chloride

4-Chlorobutyryl chloride

C4H6Cl2O (139.9796)


   

1,3-THIAZOLIN-4-ONE-2-ACETONITRILE

1,3-THIAZOLIN-4-ONE-2-ACETONITRILE

C5H4N2OS (140.0044)


   

benzoyl chloride-α-13C

benzoyl chloride-α-13C

C7H5ClO (140.0029)


   

sodium,4-hydroxy-4-oxobutanoate

sodium,4-hydroxy-4-oxobutanoate

C4H5NaO4 (140.0086)


   

Ethanethiol

Ethanethiol

C2H5BrS (139.9295)


   

(2,2,2-TRIFLUOROETHOXY)ACETONITRILE

(2,2,2-TRIFLUOROETHOXY)ACETONITRILE

C4H6Cl2O (139.9796)


   

2-Chlorobutyryl Chloride

2-Chlorobutyryl Chloride

C4H6Cl2O (139.9796)


   

5-Mercapto-1,2,3-thiadiazole sodium salt

5-Mercapto-1,2,3-thiadiazole sodium salt

C2HN2NaS2 (139.9479)


   

METHYL TRIFLUOROACRYLATE

METHYL TRIFLUOROACRYLATE

C4H3F3O2 (140.0085)


   

4-Chlorobenzaldehyde

4-Chlorobenzaldehyde

C7H5ClO (140.0029)


   

benzoyl chloride-13C6

benzoyl chloride-13C6

C7H5ClO (140.0029)


   

Ethyl Chlorofluoroacetate

Ethyl Chlorofluoroacetate

C4H6ClFO2 (140.004)


   

2-chloroisobutyryl chloride

2-chloroisobutyryl chloride

C4H6Cl2O (139.9796)


   

Thieno3,2-bthiophene

Thieno3,2-bthiophene

C6H4S2 (139.9754)


   

malonoyl chloride

malonoyl chloride

C3H2Cl2O2 (139.9432)


   

thiophene-3,4-dicarbaldehyde

thiophene-3,4-dicarbaldehyde

C6H4O2S (139.9932)


   

Oxirane,2-(1,2-dichloroethyl)-

Oxirane,2-(1,2-dichloroethyl)-

C4H6Cl2O (139.9796)


   

chromic oxalate

chromic oxalate

C2CrO4 (139.9202)


   

(R)-3-BOC-AMINO-3-(4-NITROPHENYL)PROPIONICACID

(R)-3-BOC-AMINO-3-(4-NITROPHENYL)PROPIONICACID

C4H6Cl2O (139.9796)


   

Silicon nitride

Silicon nitride

N4Si3 (139.9431)


   

Hydrazinecarboselenoamide(9CI)

Hydrazinecarboselenoamide(9CI)

CH6N3Se (139.9727)


   

cyclopentane-1,2,3,4,5-pentone

cyclopentane-1,2,3,4,5-pentone

C5O5 (139.9746)


   

trihydroxyyttrium

trihydroxyyttrium

H3O3Y (139.9141)


   

Magnesium silicate

Magnesium silicate

Mg2SiO4 (139.9267)


   

1H-Thieno[2,3-d]imidazol-2(3H)-one

1H-Thieno[2,3-d]imidazol-2(3H)-one

C5H4N2OS (140.0044)


   

Allyl(dichloro)silane

Allyl(dichloro)silane

C3H6Cl2Si (139.9616)


   

1-Bromo-3-fluoropropane

1-Bromo-3-fluoropropane

C3H6BrF (139.9637)


   

2-Chloro-2,4,6-cycloheptatrien-1-one

2-Chloro-2,4,6-cycloheptatrien-1-one

C7H5ClO (140.0029)


   

2-Propene-1-sulfonyl chloride

2-Propene-1-sulfonyl chloride

C3H5ClO2S (139.9699)


   

Cyclopropanesulfonyl chloride

Cyclopropanesulfonyl chloride

C3H5ClO2S (139.9699)


   

Cyclotrimethylene Dichlorosilane

Cyclotrimethylene Dichlorosilane

C3H6Cl2Si (139.9616)


   

2,3-Dichlorotetrahydrofuran

2,3-Dichlorotetrahydrofuran

C4H6Cl2O (139.9796)


   

2,5-Thiophenedicarboxaldehyde

2,5-Thiophenedicarboxaldehyde

C6H4O2S (139.9932)


   

2-amino-4-hydroxythiophene-3-carbonitrile

2-amino-4-hydroxythiophene-3-carbonitrile

C5H4N2OS (140.0044)


   

Sodium;phosphoric acid;fluoride

Sodium;phosphoric acid;fluoride

FH3NaO4P (139.9651)


D020011 - Protective Agents > D002327 - Cariostatic Agents > D005459 - Fluorides D001697 - Biomedical and Dental Materials

   

O-Ethyl methylphosphonothioate

O-Ethyl methylphosphonothioate

C3H9O2PS (140.0061)


   

Sodium metavanadate hydrate

Sodium metavanadate hydrate

H2NaO4V (139.929)


   

Acetoxysulfonic acid

Acetoxysulfonic acid

C2H4O5S (139.9779)


   

Propane-1-sulfonothioic O-acid

Propane-1-sulfonothioic O-acid

C3H8O2S2 (139.9966)


   

Carboxyphosphate(2-)

Carboxyphosphate(2-)

CHO6P-2 (139.9511)


   

Ethyleneglycol phosphate

Ethyleneglycol phosphate

C2H5O5P-2 (139.9875)


   

3,6-Dihydroxypyridine-2,5-dione(1-)

3,6-Dihydroxypyridine-2,5-dione(1-)

C5H2NO4- (139.9984)


An organic anion that is the conjugate base of 3,6-dihydroxypyridine-2,5-dione, obtained by selective deprotonation of the hydroxy group at positions 2.

   

2-Sulfanylideneethanesulfonic acid

2-Sulfanylideneethanesulfonic acid

C2H4O3S2 (139.9602)


   

BENZOYL CHLORIDE

BENZOYL CHLORIDE

C7H5ClO (140.0029)


   

Methylarsonic acid

Methylarsonic acid

CH5AsO3 (139.9455)


D010575 - Pesticides > D006540 - Herbicides D009676 - Noxae > D013723 - Teratogens D016573 - Agrochemicals

   

Sulfoacetate

SULFOACETIC ACID

C2H4O5S (139.9779)


A carboxyalkanesulfonic acid that is the C-sulfo derivative of acetic acid.

   

Methyl ethyl trisulfide

Methyl ethyl trisulfide

C3H8S3 (139.9788)


   

thieno[2,3-b]thiophene

thieno[2,3-b]thiophene

C6H4S2 (139.9754)


   

acetyl dihydrogen phosphate

acetyl dihydrogen phosphate

C2H5O5P (139.9875)


An acyl monophosphate in which the acyl group specified is acetyl.

   

Chlorobenzaldehyde

Chlorobenzaldehyde

C7H5ClO (140.0029)


   

methanesulfonyl(methylsulfanyl)methane

methanesulfonyl(methylsulfanyl)methane

C3H8O2S2 (139.9966)


   

1,2,4-trithiolan-1-ium-1-olate

1,2,4-trithiolan-1-ium-1-olate

C2H4OS3 (139.9424)


   

thiophene-2,5-dicarbaldehyde

thiophene-2,5-dicarbaldehyde

C6H4O2S (139.9932)


   

(1s)-1,2,4-trithiolan-1-ium-1-olate

(1s)-1,2,4-trithiolan-1-ium-1-olate

C2H4OS3 (139.9424)


   

thiophene-2,3-dicarbaldehyde

thiophene-2,3-dicarbaldehyde

C6H4O2S (139.9932)


   

1,2,4-trithiolan-4-ium-4-olate

1,2,4-trithiolan-4-ium-4-olate

C2H4OS3 (139.9424)


   

5,6-dihydro-4h-1λ⁴,2λ⁴,3-trithiine

5,6-dihydro-4h-1λ⁴,2λ⁴,3-trithiine

C3H8S3 (139.9788)