Exact Mass: 260.0063

Exact Mass Matches: 260.0063

Found 85 metabolites which its exact mass value is equals to given mass value 260.0063, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

BROMACIL

BROMACIL

C9H13BrN2O2 (260.016)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals CONFIDENCE standard compound; INTERNAL_ID 1265; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3915; ORIGINAL_PRECURSOR_SCAN_NO 3912 CONFIDENCE standard compound; INTERNAL_ID 1265; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3781; ORIGINAL_PRECURSOR_SCAN_NO 3780 CONFIDENCE standard compound; INTERNAL_ID 1265; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3766; ORIGINAL_PRECURSOR_SCAN_NO 3764 CONFIDENCE standard compound; INTERNAL_ID 1265; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3789; ORIGINAL_PRECURSOR_SCAN_NO 3784 CONFIDENCE standard compound; INTERNAL_ID 1265; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3917; ORIGINAL_PRECURSOR_SCAN_NO 3915 CONFIDENCE standard compound; INTERNAL_ID 1265; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3887; ORIGINAL_PRECURSOR_SCAN_NO 3886 CONFIDENCE standard compound; EAWAG_UCHEM_ID 266

   

Phosphatidylcholine O-34:2

Phosphorodithioic acid, O,O-diethyl S-((ethylthio)methyl) ester

C7H17O2PS3 (260.0128)


Phosphatidylcholine O-34:2, also known as Thimet or O,O-Diethyl S-ethylmercaptomethyl dithiophosphate, is classified as a member of the Dithiophosphate O-esters. Dithiophosphate O-esters are o-ester derivatives of dithiophosphates, with the general structure RSP(O)(O)=S (R = organyl group). Phosphatidylcholine O-34:2 is a non-carcinogenic (not listed by IARC) potentially toxic compound D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

5-Methylthioribose 1-phosphate

{[(2R,3R,4S,5S)-3,4-dihydroxy-5-[(methylsulfanyl)methyl]oxolan-2-yl]oxy}phosphonic acid

C6H13O7PS (260.012)


5-Methylthioribose 1-phosphate belongs to the class of organic compounds known as pentoses. These are monosaccharides in which the carbohydrate moiety contains five carbon atoms. 5-Methylthioribose 1-phosphate is an intermediate in methionine biosynthesis. It is converted from 5-deoxy-5-methylthioadenosine by 5-deoxy-5-methylthioadenosine phosphorylase. Then it is converted to methionine (PMID: 2153115). In the methionine salvage pathway, 5-methylthioribose 1-phosphate isomerase (M1Pi) catalyzes the conversion of 5-methylthioribose 1-phosphate (MTR-1-P) into 5-methylthioribulose 1-phosphate (MTRu-1-P). 5-Methylthioribose 1-phosphate is an intermediate in methionine biosynthesis. It is converted from 5-Deoxy-5-methylthioadenosine by 5-Deoxy-5-methylthioadenosine phosphorylase. Then it is converted to methionine (PMID 2153115). In the methionine salvage pathway 5-methylthioribose 1-phosphate isomerase (M1Pi) catalyzes the conversion of 5-methylthioribose 1-phosphate (MTR-1-P) to 5-methylthioribulose 1-phosphate (MTRu-1-P) [HMDB]

   

S-methyl-5-thio-D-ribulose 1-phosphate(2-)

{[3,4-dihydroxy-5-(methylsulphanyl)-2-oxopentyl]oxy}phosphonic acid

C6H13O7PS (260.012)


S-methyl-5-thio-D-ribulose 1-phosphate(2-) is also known as 1-phospho-5-S-Methylthioribulose or 1-PMT-Ribulose. S-methyl-5-thio-D-ribulose 1-phosphate(2-) is considered to be soluble (in water) and acidic

   

5-Methylthioribulose 1-phosphate

{[(3R,4S)-3,4-dihydroxy-5-(methylsulfanyl)-2-oxopentyl]oxy}phosphonic acid

C6H13O7PS (260.012)


5-Methylthioribulose 1-phosphate is an intermediate in the methionine salvage pathway. It is a microbial metabolite produced by gut microbes during methionine generation from methylthioadenosine. The first step is the phosphorolysis of methylthioadenosine to 5-methylthioribose-1-phosphate and adenine by the enzyme 5-deoxy- 5-methylthioadenosine phosphorylase (methylthioadenosine phosphorylase); 5-methylthioribose-1-phosphate is then converted to 5-methylthioribulose-1-phosphate (PMID: 6725268). 5-Deoxy-5-methylthioadenosine (methylthioadenosine) is a metabolite of S-adenosyl-L-methionine formed during the synthesis of the polyamines, spermidine and spermine. [HMDB]. 5-Methylthioribulose 1-phosphate is found in many foods, some of which are fireweed, lemon verbena, parsley, and fox grape. 5-Methylthioribulose 1-phosphate is an intermediate in the methionine salvage pathway. It is a microbial metabolite produced by gut microbes during methionine generation from methylthioadenosine. The first step is the phosphorolysis of methylthioadenosine to 5-methylthioribose-1-phosphate and adenine by the enzyme 5-deoxy- 5-methylthioadenosine phosphorylase (methylthioadenosine phosphorylase); 5-methylthioribose-1-phosphate is then converted to 5-methylthioribulose-1-phosphate (PMID: 6725268). 5-Deoxy-5-methylthioadenosine (methylthioadenosine) is a metabolite of S-adenosyl-L-methionine formed during the synthesis of the polyamines, spermidine and spermine.

   

Caffeic acid 4-O-sulfate

(2E)-3-[3-Hydroxy-4-(sulphooxy)phenyl]prop-2-enoic acid

C9H8O7S (259.9991)


Caffeic acid 4-sulfate, also known as caffeate 4-sulphate or caffeic acid 4-sulphuric acid, is a member of the class of compounds known as hydroxycinnamic acids. Hydroxycinnamic acids are compounds containing an cinnamic acid where the benzene ring is hydroxylated. Caffeic acid 4-sulfate is practically insoluble (in water) and an extremely strong acidic compound (based on its pKa). Caffeic acid 4-sulfate can be found primarily in blood and urine. Within the cell, caffeic acid 4-sulfate is primarily located in the cytoplasm. It can also be found in the extracellular space. Caffeic acid 4-O-sulfate (CAS: 1213651-94-5) is a polyphenol metabolite detected in biological fluids (PMID: 20428313). Caffeic acid sulfate was found to be elevated in rat urine after whole rye consumption which makes this compound a potential urinary biomarker of whole grain intake (PMID: 26862900).

   

Caffeic acid 3-O-sulfate

(2E)-3-[4-Hydroxy-3-(sulfooxy)phenyl]-2-propenoic acid

C9H8O7S (259.9991)


Caffeic acid 3-O-sulfate (CAS: 1208232-16-9) is a polyphenol metabolite detected in biological fluids (PMID: 20428313). Caffeic acid sulfate was found to be elevated in rat urine after whole rye consumption which makes this compound a potential urinary biomarker of whole grain intake (PMID: 26862900).

   

3,5-Dihydroxycinnamic acid sulfate

(2E)-3-[3-Hydroxy-5-(sulphooxy)phenyl]prop-2-enoic acid

C9H8O7S (259.9991)


   

2-Mercapto-3-phenylthieno[3,2-d]pyrimidin-4(3H)-one

3-phenyl-2-sulfanylidene-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-4-one

C12H8N2OS2 (260.0078)


   
   

p-sulfooxyphenylpyruvic acid

p-sulfooxyphenylpyruvic acid

C9H8O7S (259.9991)


   

1-(methylsulfanyl)xylulose 5-phosphate

1-(methylsulfanyl)xylulose 5-phosphate

C6H13O7PS (260.012)


   

petunidin-3-glucoside

petunidin-3-glucoside

C7H17O2PS3 (260.0128)


   

Methylthioribosyl phosphate

Methylthioribosyl phosphate

C6H13O7PS (260.012)


   

Caffeic acid 3-sulfate

(2E)-3-[4-hydroxy-3-(sulfooxy)phenyl]prop-2-enoic acid

C9H8O7S (259.9991)


An aryl sulfate that is trans-caffeic acid in which the phenolic hydrogen at position 3 is replaced by a sulfo group. A metabolite from coffee.

   

Caffeic acid 4-sulfate

(2E)-3-[3-hydroxy-4-(sulfooxy)phenyl]prop-2-enoic acid

C9H8O7S (259.9991)


   

5-(3,5-DICHLOROPHENYL)-5-OXOVALERIC ACID

5-(3,5-DICHLOROPHENYL)-5-OXOVALERIC ACID

C11H10Cl2O3 (260.0007)


   

1-Iodo-4-(2-methyl-2-propanyl)benzene

1-Iodo-4-(2-methyl-2-propanyl)benzene

C10H13I (260.0062)


   

sodium,formaldehyde,naphthalene-1-sulfonate

sodium,formaldehyde,naphthalene-1-sulfonate

C11H9NaO4S (260.0119)


   

1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclopropanecarbonyl chloride

1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)cyclopropanecarbonyl chloride

C11H7ClF2O3 (260.0052)


   

1-((4-BROMOTHIOPHEN-2-YL)METHYL)PIPERAZINE

1-((4-BROMOTHIOPHEN-2-YL)METHYL)PIPERAZINE

C9H13BrN2S (259.9983)


   

TRIMETHYL 4-BROMOORTHOBENZOATE

TRIMETHYL 4-BROMOORTHOBENZOATE

C10H13BrO3 (260.0048)


   

1-(4-iodophenyl)butane

1-(4-iodophenyl)butane

C10H13I (260.0062)


   

Methyl 5H-perfluoropentanoate

Methyl 5H-perfluoropentanoate

C6H4F8O2 (260.0084)


   

Methyl 5-(Trifluoromethyl)-1-Benzothiophene-2-Carboxylate

Methyl 5-(Trifluoromethyl)-1-Benzothiophene-2-Carboxylate

C11H7F3O2S (260.0119)


   

2,3,5,6-Tetramethyliodobenzene

2,3,5,6-Tetramethyliodobenzene

C10H13I (260.0062)


   

1-IODO-3-TERT-BUTYLBENZENE

1-IODO-3-TERT-BUTYLBENZENE

C10H13I (260.0062)


   

5,6-dichloro-N-(2-oxobutyl)pyridine-3-carboxamide

5,6-dichloro-N-(2-oxobutyl)pyridine-3-carboxamide

C10H10Cl2N2O2 (260.0119)


   

BIS(2 2 2-TRIFLUOROETHYL)METHYLPHOSPHON&

BIS(2 2 2-TRIFLUOROETHYL)METHYLPHOSPHON&

C5H7F6O3P (260.0037)


   

1-Thianthrenylboronic acid

1-Thianthrenylboronic acid

C12H9BO2S2 (260.0137)


   

2,4-bis(trifluoromethyl)pyrimidine-5-carboxylic acid

2,4-bis(trifluoromethyl)pyrimidine-5-carboxylic acid

C7H2F6N2O2 (260.002)


   

4-BROMO-1-(TERT-BUTYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID

4-BROMO-1-(TERT-BUTYL)-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID

C9H13BrN2O2 (260.016)


   

4-BROMO-3-ETHYL-1-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER

4-BROMO-3-ETHYL-1-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER

C9H13BrN2O2 (260.016)


   

Benzene,2-(2-bromoethoxy)-1,3-dimethoxy-

Benzene,2-(2-bromoethoxy)-1,3-dimethoxy-

C10H13BrO3 (260.0048)


   

5-BROMOMETHYL-1,2,3-TRIMETHOXY-BENZENE

5-BROMOMETHYL-1,2,3-TRIMETHOXY-BENZENE

C10H13BrO3 (260.0048)


   

3-(2-chloro-3,4-dimethoxyphenyl)prop-2-enoyl chloride

3-(2-chloro-3,4-dimethoxyphenyl)prop-2-enoyl chloride

C11H10Cl2O3 (260.0007)


   

4-Bromo-1-methoxy-2-(2-methoxyethoxy)benzene

4-Bromo-1-methoxy-2-(2-methoxyethoxy)benzene

C10H13BrO3 (260.0048)


   

2-methyl-4-oxo-4-(3,4-dichlorophenyl)butyric acid

2-methyl-4-oxo-4-(3,4-dichlorophenyl)butyric acid

C11H10Cl2O3 (260.0007)


   

Ethyl 3-(2,5-dichlorophenyl)-3-oxopropanoate

Ethyl 3-(2,5-dichlorophenyl)-3-oxopropanoate

C11H10Cl2O3 (260.0007)


   

4-(2,2-DIMETHOXYETHOXY)BROMOBENZENE

4-(2,2-DIMETHOXYETHOXY)BROMOBENZENE

C10H13BrO3 (260.0048)


   

(E)-2-(2-TOSYLHYDRAZONO)ACETYL CHLORIDE

(E)-2-(2-TOSYLHYDRAZONO)ACETYL CHLORIDE

C9H9ClN2O3S (260.0022)


   

1-chloro-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-one

1-chloro-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-one

C11H13ClOS2 (260.0096)


   

N-(2-acetamido-4,5-dichlorophenyl)acetamide

N-(2-acetamido-4,5-dichlorophenyl)acetamide

C10H10Cl2N2O2 (260.0119)


   

6,8-DICHLORO-CHROMAN-3-CARBOXYLIC ACID METHYL ESTER

6,8-DICHLORO-CHROMAN-3-CARBOXYLIC ACID METHYL ESTER

C11H10Cl2O3 (260.0007)


   

Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate

Ethyl 3-(3,5-dichlorophenyl)-3-oxopropanoate

C11H10Cl2O3 (260.0007)


   

4-Bromo-2-methoxy-1-(2-methoxyethoxy)benzene

4-Bromo-2-methoxy-1-(2-methoxyethoxy)benzene

C10H13BrO3 (260.0048)


   

(5-BROMO-2-HYDROXY)BENZENEBORONICACID

(5-BROMO-2-HYDROXY)BENZENEBORONICACID

C9H13BrN2O2 (260.016)


   

TERT-BUTYL 4-BROMO-3-METHYL-1H-PYRAZOLE-1-CARBOXYLATE

TERT-BUTYL 4-BROMO-3-METHYL-1H-PYRAZOLE-1-CARBOXYLATE

C9H13BrN2O2 (260.016)


   

2-Pentafluorophenyl-acetamidine HCl

2-Pentafluorophenyl-acetamidine HCl

C8H6ClF5N2 (260.014)


   

(3S)-7-Hydroxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid

(3S)-7-Hydroxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid

C5H13N2O4PS2 (260.0054)


   

1-iodo-2,3,4,5-tetramethylbenzene

1-iodo-2,3,4,5-tetramethylbenzene

C10H13I (260.0062)


   

2-(4-bromophenyl)-2-(hydroxymethyl)propane-1,3-diol

2-(4-bromophenyl)-2-(hydroxymethyl)propane-1,3-diol

C10H13BrO3 (260.0048)


   

8-Chlorodibenzo[b,f]thiepin-10(11H)-one

8-Chlorodibenzo[b,f]thiepin-10(11H)-one

C14H9ClOS (260.0063)


   

3-(3,5-Dichloro-4-methylbenzoyl)propionic acid

3-(3,5-Dichloro-4-methylbenzoyl)propionic acid

C11H10Cl2O3 (260.0007)


   

tert-Butyl 3-(bromomethyl)pyrazole-1-carboxylate

tert-Butyl 3-(bromomethyl)pyrazole-1-carboxylate

C9H13BrN2O2 (260.016)


   

ethyl 3-(3,4-dichlorophenyl)-3-oxopropanoate

ethyl 3-(3,4-dichlorophenyl)-3-oxopropanoate

C11H10Cl2O3 (260.0007)


   

pyridostigmine bromide

pyridostigmine bromide

C9H13BrN2O2 (260.016)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D004791 - Enzyme Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   
   

6-(5-Chloro-2-pyridyl)-5H-pyrrolo[3,4-b]pyrazine-5,7(6H)-dione

6-(5-Chloro-2-pyridyl)-5H-pyrrolo[3,4-b]pyrazine-5,7(6H)-dione

C11H5ClN4O2 (260.0101)


   

Methyl 4-(trifluoromethyl)-1-benzothiophene-2-carboxylate

Methyl 4-(trifluoromethyl)-1-benzothiophene-2-carboxylate

C11H7F3O2S (260.0119)


   

(4-BOC-AMINO-PIPERIDIN-1-YL)-PYRIDIN-3-YL-ACETICACID

(4-BOC-AMINO-PIPERIDIN-1-YL)-PYRIDIN-3-YL-ACETICACID

C9H13BrN2O2 (260.016)


   

Ethyl 2,6-dichlorobenzoylacetate

Ethyl 2,6-dichlorobenzoylacetate

C11H10Cl2O3 (260.0007)


   

Ethyl 3-(2,4-dichlorophenyl)-3-oxopropanoate

Ethyl 3-(2,4-dichlorophenyl)-3-oxopropanoate

C11H10Cl2O3 (260.0007)


   

7-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER

7-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER

C11H7F3O2S (260.0119)


   

6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER

6-TRIFLUOROMETHYL-BENZO[B]THIOPHENE-2-CARBOXYLIC ACID METHYL ESTER

C11H7F3O2S (260.0119)


   

5-(3,4-dichlorophenyl)-5-oxopentanoic acid

5-(3,4-dichlorophenyl)-5-oxopentanoic acid

C11H10Cl2O3 (260.0007)


   

ETHYL 2-(4-BROMO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)ACETATE

ETHYL 2-(4-BROMO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)ACETATE

C9H13BrN2O2 (260.016)


   

Lawrencium

Lawrencium

Lr (260)


   

N-(1,3-benzothiazol-2-yl)-2-thiophenecarboxamide

N-(1,3-benzothiazol-2-yl)-2-thiophenecarboxamide

C12H8N2OS2 (260.0078)


   

phorate

6Z-8-Hydroxygeraniol 8-O-glucoside

C7H17O2PS3 (260.0128)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals Constituent of fresh ginger (Zingiber officinale). 6Z-8-Hydroxygeraniol 8-O-glucoside is found in herbs and spices.

   

1-(Methylthio)ribulose 5-phosphate

1-(Methylthio)ribulose 5-phosphate

C6H13O7PS (260.012)


A ketopentose phosphate that is D-ribulose 5-phosphate in which the 1-hydroxy group is replaced by a methylthio group.

   

2-(2-phenylethyl)-thiohydroximate-O-sulfate

2-(2-phenylethyl)-thiohydroximate-O-sulfate

C9H10NO4S2- (260.0051)


   

[(2R,3S)-2,3-dihydroxy-5-methylsulfanyl-4-oxopentyl] dihydrogen phosphate

[(2R,3S)-2,3-dihydroxy-5-methylsulfanyl-4-oxopentyl] dihydrogen phosphate

C6H13O7PS (260.012)


   

3,5-Dihydroxycinnamic acid sulfate

3,5-Dihydroxycinnamic acid sulfate

C9H8O7S (259.9991)


   

5-Methylthioribose 1-phosphate

5-Methylthioribose 1-phosphate

C6H13O7PS (260.012)


   
   

2-Oxo-3-(4-sulooxyphenyl)propanoic acid

2-Oxo-3-(4-sulooxyphenyl)propanoic acid

C9H8O7S (259.9991)


   
   

S-Methyl-5-thio-D-ribulose 1-phosphate

S-Methyl-5-thio-D-ribulose 1-phosphate

C6H13O7PS (260.012)


   

S-Methyl-5-thio-alpha-D-ribose 1-phosphate

S-Methyl-5-thio-alpha-D-ribose 1-phosphate

C6H13O7PS (260.012)


   

S-Methyl-1-thio-D-xylulose 5-phosphate

S-Methyl-1-thio-D-xylulose 5-phosphate

C6H13O7PS (260.012)


   

S-Methyl-1-thio-D-ribulose 5-phosphate

S-Methyl-1-thio-D-ribulose 5-phosphate

C6H13O7PS (260.012)


   

Methylthioribose phosphate

Methylthioribose phosphate

C6H13O7PS (260.012)


   

(2z)-2-hydroxy-3-[4-(sulfooxy)phenyl]prop-2-enoic acid

(2z)-2-hydroxy-3-[4-(sulfooxy)phenyl]prop-2-enoic acid

C9H8O7S (259.9991)


   

2-hydroxy-3-[4-(sulfooxy)phenyl]prop-2-enoic acid

2-hydroxy-3-[4-(sulfooxy)phenyl]prop-2-enoic acid

C9H8O7S (259.9991)