Exact Mass: 169.013698

Exact Mass Matches: 169.013698

Found 126 metabolites which its exact mass value is equals to given mass value 169.013698, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Glyphosate

2-[(phosphonomethyl)amino]acetic acid

C3H8NO5P (169.0140088)


D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D004791 - Enzyme Inhibitors > D014475 - Uncoupling Agents D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals Glyphosate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=1071-83-6 (retrieved 2024-09-27) (CAS RN: 1071-83-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

Cysteic acid

2-Amino-3-sulfopropionic acid

C3H7NO5S (169.00449319999998)


Cysteic acid is a crystalline amino acid formed in the oxidation of cysteine; it is a precursor of taurine. A crystalline amino acid formed in the oxidation of cysteine; it is a precursor of taurine. [HMDB]

   

2-Amino-3-phosphonopropionic acid

2-Amino-3-phosphonopropionic acid, sodium salt

C3H8NO5P (169.0140088)


2-Amino-3-phosphonopropionic acid (AP-3 or 2-AP3), also known as 3-phosphonoalanine, is a non-proteinogenc alpha-amino acid that is alanine in which one of the hydrogens of the terminal methyl group has been replaced by a dihydroxy(oxido)-lambda(5)-phosphanyl group. It is found in many organisms ranging from microbes to invertebrates to animals. In humans AP-3 is found in diverse tissues, such as liver, intestine and spleen. (PMID: 2627760). 2-Amino-3-phosphonopropionic acid is a ubiquitous naturally occurring phosphonate used as a source of phosphorus by many prokaryotic organisms (PMID: 30119975). The natural occurrence of 2-amino-3-phosphonopropionic acid. the phosphonate analogue of aspartic acid, was first reported by Kittredge & Hughes (PMID: 14214094) in the sea anemone Zoanthus sociatus and the protozoon Tetrahymena pyriformis. It has since been established to be one of the most widely distributed of the biogenic C–P compounds, particularly among the lower marine invertebrates (PMID: 19191873). AP-3 has been determined to be a metabotropic glutamate receptor agonist (PMID: 8836635). It has been shown to block the amyloid precursor protein (APP) release evoked by glutamate receptor stimulation in neurons of the cortex and hippocampus. APP accumulation is believed to produce the damage in Alzheimer’s disease (PMID: 7644542). 2-Amino-3-phosphonopropionic acid (AP-3)is a normal human metabolite found in diverse tissues, such as liver, intestine and spleen. (PMID 2627760) AP-3 is a metabotropic glutamate receptor agonist (PMID 8836635) shown to block the amyloid precursor protein (APP) release evoked by glutamate receptor stimulation in neurons of the cortex and hippocampus; APP accumulation is believed to produce the damage in Alzheimer disease (PMID 7644542) [HMDB] D018377 - Neurotransmitter Agents > D018683 - Excitatory Amino Acid Agents > D018691 - Excitatory Amino Acid Antagonists KEIO_ID A131 DL-AP3 is a competitive mGluR1 and mGluR5 antagonist. DL-AP3 is also an inhibitor of phosphoserine phosphatase. DL-AP3 has neuroprotective effect[1][2][3].

   

3-Amino-2-oxopropyl phosphate

1-Amino-3-(phosphohydroxy)propan-2-one

C3H8NO5P (169.0140088)


   

Alanylphosphate

D-Alanine,monoanhydride with phosphoric acid (9CI)

C3H8NO5P (169.0140088)


   

Thiobenzamide S,S-dioxide

Thiobenzamide S,S-dioxide

C7H7NO2S (169.0197482)


   

2-Amino-6-chloropurine

6-chloro-2,3-dihydro-1H-purin-2-imine

C5H4ClN5 (169.0155214)


   

2-Chloroadenine

2-chloro-7H-purin-6-amine

C5H4ClN5 (169.0155214)


   

L-Cysteic acid

(2R)-2-Amino-3-sulphopropanoic acid

C3H7NO5S (169.0044932)


Cysteinesulfonic acid, also known as (2r)-2-amino-3-sulfopropanoic acid or 3-sulfoalanine, is a member of the class of compounds known as L-alpha-amino acids. L-alpha-amino acids are alpha amino acids which have the L-configuration of the alpha-carbon atom. Cysteinesulfonic acid is soluble (in water) and an extremely strong acidic compound (based on its pKa). Cysteinesulfonic acid can be found in a number of food items such as roman camomile, pili nut, chicory, and garden tomato, which makes cysteinesulfonic acid a potential biomarker for the consumption of these food products.

   

2-Amino-6-chloropurine

2-Amino-6-chloropurine

C5H4ClN5 (169.0155214)


   

L-Cysteic acid

L-Cysteic acid

C3H7NO5S (169.00449319999998)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.054 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.052 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.051

   

Cysteic Acid

dl-cysteic acid

C3H7NO5S (169.00449319999998)


An amino sulfonic acid that is the sulfonic acid analogue of cysteine.

   

2-Amino-3-phosphonopropionic acid

2-Amino-3-phosphonopropionic acid

C3H8NO5P (169.0140088)


DL-AP3 is a competitive mGluR1 and mGluR5 antagonist. DL-AP3 is also an inhibitor of phosphoserine phosphatase. DL-AP3 has neuroprotective effect[1][2][3].

   

Glyphosate [M+H+]

Glyphosate [M+H+]

C3H8NO5P (169.0140088)


   

Glyphosate [M+Na+]

Glyphosate [M+Na+]

C3H8NO5P (169.0140088)


   

Glyphosat [M+Na+]

Glyphosat [M+Na+]

C3H8NO5P (169.0140088)


   
   
   

6-Chloroguanine

2-Amino-6-chloropurine

C5H4ClN5 (169.0155214)


   

1H-Imidazole-4-carbonyl chloride, 5-cyano-1-methyl- (9CI)

1H-Imidazole-4-carbonyl chloride, 5-cyano-1-methyl- (9CI)

C6H4ClN3O (169.00428839999998)


   

2-Fluoro-3-nitrobenzaldehyde

2-Fluoro-3-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

(4,4,4-TRIFLUOROBUTYL)THIOCYANATE

(4,4,4-TRIFLUOROBUTYL)THIOCYANATE

C5H6F3NS (169.0173032)


   

L-AP3

L-Alanine, 3-phosphono-

C3H8NO5P (169.0140088)


D018377 - Neurotransmitter Agents > D018683 - Excitatory Amino Acid Agents > D018691 - Excitatory Amino Acid Antagonists

   

(PYRIDIN-2-YLSULFANYL)-ACETIC ACID

(PYRIDIN-2-YLSULFANYL)-ACETIC ACID

C7H7NO2S (169.0197482)


   

2-Aminomethylimidazole dihydrochloride

2-Aminomethylimidazole dihydrochloride

C4H9Cl2N3 (169.0173494)


   

L-ASPARTIC ACID HYDROCHLORIDE

L-ASPARTIC ACID HYDROCHLORIDE

C4H8ClNO4 (169.0141838)


   

2-Chloro-4-fluorophenylacetonitrile

2-Chloro-4-fluorophenylacetonitrile

C8H5ClFN (169.00945320000002)


   

5-Fluoro-2-nitrobenzaldehyde

5-Fluoro-2-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

6-chloro-3H,4H-pyrrolo[2,1-f][1,2,4]triazin-4-one

6-chloro-3H,4H-pyrrolo[2,1-f][1,2,4]triazin-4-one

C6H4ClN3O (169.00428839999998)


   

3-Fluoro-4-nitrobenzaldehyde

3-Fluoro-4-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   
   

(E)-3-(2-METHYLTHIAZOL-4-YL)ACRYLIC ACID

(E)-3-(2-METHYLTHIAZOL-4-YL)ACRYLIC ACID

C7H7NO2S (169.0197482)


   

4-Fluoro-3-nitrobenzaldehyde

4-Fluoro-3-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

2-Chloro-5-fluorophenylacetonitrile

2-Chloro-5-fluorophenylacetonitrile

C8H5ClFN (169.00945320000002)


   
   
   

4-CHLORO-2-FLUOROBENZYLISOCYANIDE

4-CHLORO-2-FLUOROBENZYLISOCYANIDE

C8H5ClFN (169.00945320000002)


   

Methyl (2-nitrophenyl)sulfane

Methyl (2-nitrophenyl)sulfane

C7H7NO2S (169.0197482)


   

7-CHLOROIMIDAZO[1,2-A]PYRIMIDIN-5(1H)-ONE

7-CHLOROIMIDAZO[1,2-A]PYRIMIDIN-5(1H)-ONE

C6H4ClN3O (169.00428839999998)


   

4-Amino-3-sulfanylbenzoic acid

4-Amino-3-sulfanylbenzoic acid

C7H7NO2S (169.0197482)


   

2-Fluoro-6-nitrobenzaldehyde

2-Fluoro-6-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

4-nitrophenyl methyl sulfide

4-nitrophenyl methyl sulfide

C7H7NO2S (169.0197482)


   

methyl 3-nitrophenyl sulfide

methyl 3-nitrophenyl sulfide

C7H7NO2S (169.0197482)


   

7-CHLORO-3-METHYL-3H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDINE

7-CHLORO-3-METHYL-3H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDINE

C5H4ClN5 (169.0155214)


   

3,5-DINITROPYRIDINE

3,5-DINITROPYRIDINE

C5H3N3O4 (169.0123558)


   

4-(Chloromethyl)-3-fluorobenzonitrile

4-(Chloromethyl)-3-fluorobenzonitrile

C8H5ClFN (169.00945320000002)


   
   

6-CHLORO[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-3-AMINE

6-CHLORO[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-3-AMINE

C5H4ClN5 (169.0155214)


   
   

1-METHYL-1H-PYRAZOL-4-AMINE DIHYDROCHLORIDE

1-METHYL-1H-PYRAZOL-4-AMINE DIHYDROCHLORIDE

C4H9Cl2N3 (169.0173494)


   
   

Pyridine, 2,3-dinitro-

Pyridine, 2,3-dinitro-

C5H3N3O4 (169.0123558)


   

5-Chloro-1H-imidazo[4,5-b]pyridin-2(3H)-one

5-Chloro-1H-imidazo[4,5-b]pyridin-2(3H)-one

C6H4ClN3O (169.00428839999998)


   

(4-Pyridinylsulfanyl)acetic acid

(4-Pyridinylsulfanyl)acetic acid

C7H7NO2S (169.0197482)


   

2-CHLORO-6-FLUORO-3-METHYLBENZONITRILE

2-CHLORO-6-FLUORO-3-METHYLBENZONITRILE

C8H5ClFN (169.00945320000002)


   

6-CHLORO-1H-IMIDAZO[4,5-B]PYRIDIN-2(3H)-ONE

6-CHLORO-1H-IMIDAZO[4,5-B]PYRIDIN-2(3H)-ONE

C6H4ClN3O (169.00428839999998)


   

(4-Chloro-3-fluorophenyl)acetonitrile

(4-Chloro-3-fluorophenyl)acetonitrile

C8H5ClFN (169.00945320000002)


   

4-Chloro-2-fluorobenzyl cyanide

4-Chloro-2-fluorophenylacetonitrile

C8H5ClFN (169.00945320000002)


   

(3-Chloro-5-fluorophenyl)acetonitrile

(3-Chloro-5-fluorophenyl)acetonitrile

C8H5ClFN (169.00945320000002)


   

1-(1H-Imidazol-4-yl)methanamine dihydrochloride

1-(1H-Imidazol-4-yl)methanamine dihydrochloride

C4H9Cl2N3 (169.0173494)


   

3-Chloro-2-fluorobenzyl cyanide

3-Chloro-2-fluorobenzyl cyanide

C8H5ClFN (169.00945320000002)


   

4-Chloro-3H-imidazo[4,5-c]pyridin-2-ol

4-Chloro-3H-imidazo[4,5-c]pyridin-2-ol

C6H4ClN3O (169.00428839999998)


   

2-Chloro-6-fluorophenylacetonitrile

2-Chloro-6-fluorophenylacetonitrile

C8H5ClFN (169.00945320000002)


   

trisodium hydrogen bis[N-(phosphonatomethyl)aminoacetate]

trisodium hydrogen bis[N-(phosphonatomethyl)aminoacetate]

C3H8NO5P (169.0140088)


   

5-Acetylthiophene-2-carboxamide

5-Acetylthiophene-2-carboxamide

C7H7NO2S (169.0197482)


   

4-Cyclopropyl-1,3-thiazole-2-carboxylic Acid

4-Cyclopropyl-1,3-thiazole-2-carboxylic Acid

C7H7NO2S (169.0197482)


   

6-Chloro-2-hydroxyimidazo[1,2-b]pyridazine

6-Chloro-2-hydroxyimidazo[1,2-b]pyridazine

C6H4ClN3O (169.00428839999998)


   

5-Chloro-2-fluorophenylacetonitrile

5-Chloro-2-fluorophenylacetonitrile

C8H5ClFN (169.00945320000002)


   

2-(2-nitroprop-1-enyl)thiophene

2-(2-nitroprop-1-enyl)thiophene

C7H7NO2S (169.0197482)


   

6-CHLORO-3 5-DIAMINO-2-PYRAZINE-

6-CHLORO-3 5-DIAMINO-2-PYRAZINE-

C5H4ClN5 (169.0155214)


   

Acetamide,N-(5-formyl-2-thienyl)-

Acetamide,N-(5-formyl-2-thienyl)-

C7H7NO2S (169.0197482)


   
   

2-Chloro-4-methoxy-5-pyrimidinecarbonitrile

2-Chloro-4-methoxy-5-pyrimidinecarbonitrile

C6H4ClN3O (169.00428839999998)


   

D-AP3

3-Phosphono-D-alanine

C3H8NO5P (169.0140088)


   

7-chlorobenzo[c][1,2,5]oxadiazol-4-amine

7-chlorobenzo[c][1,2,5]oxadiazol-4-amine

C6H4ClN3O (169.00428839999998)


   

4-Fluoro-2-nitrobenzaldehyde

4-Fluoro-2-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

3-Fluoro-2-nitrobenzaldehyde

3-Fluoro-2-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

2-Fluoro-4-nitrobenzaldehyde

2-Fluoro-4-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

2-Fluoro-5-nitrobenzaldehyde

2-Fluoro-5-nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

2-Chlor-4-fluor-3-methylbenzonitril

2-Chlor-4-fluor-3-methylbenzonitril

C8H5ClFN (169.00945320000002)


   

Pyridine, 2,4-dinitro-

Pyridine, 2,4-dinitro-

C5H3N3O4 (169.0123558)


   

Pyridine, 2,5-dinitro-

Pyridine, 2,5-dinitro-

C5H3N3O4 (169.0123558)


   

Pyridine, 3,4-dinitro-

Pyridine, 3,4-dinitro-

C5H3N3O4 (169.0123558)


   

(3-nitrobenzyl)mercaptan

(3-nitrobenzyl)mercaptan

C7H7NO2S (169.0197482)


   

2-CHLORO-5H-PYRROLO[2,3-D]PYRIMIDIN-6(7H)-ONE

2-CHLORO-5H-PYRROLO[2,3-D]PYRIMIDIN-6(7H)-ONE

C6H4ClN3O (169.00428839999998)


   

4-Chloro-5H-pyrrolo[2,3-d]pyrimidin-6(7H)-one

4-Chloro-5H-pyrrolo[2,3-d]pyrimidin-6(7H)-one

C6H4ClN3O (169.00428839999998)


   

1,2-Benzisothiazole,2,3-dihydro-, 1,1-dioxide

1,2-Benzisothiazole,2,3-dihydro-, 1,1-dioxide

C7H7NO2S (169.0197482)


   

7-chloro-1,3-dihydroimidazo[4,5-c]pyridin-2-one

7-chloro-1,3-dihydroimidazo[4,5-c]pyridin-2-one

C6H4ClN3O (169.00428839999998)


   

2-(methylthio)nicotinic acid

2-(methylthio)nicotinic acid

C7H7NO2S (169.0197482)


   

6-chloro-2-fluoro-3-methylbenzonitrile

6-chloro-2-fluoro-3-methylbenzonitrile

C8H5ClFN (169.00945320000002)


   

2-Methyl-5-nitrobenzenethiol

2-Methyl-5-nitrobenzenethiol

C7H7NO2S (169.0197482)


   

8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

C6H4ClN3O (169.00428839999998)


   

2-chloro-1H,4H-pyrrolo[2,1-f][1,2,4]triazin-4-one

2-chloro-1H,4H-pyrrolo[2,1-f][1,2,4]triazin-4-one

C6H4ClN3O (169.00428839999998)


   

2-deuteriooxy-1,1,1,3,3,3-hexafluoropropane

2-deuteriooxy-1,1,1,3,3,3-hexafluoropropane

C3HDF6O (169.00726057799997)


   

3-Chloro-4-fluorobenzyl cyanide

3-Chloro-4-fluorobenzyl cyanide

C8H5ClFN (169.00945320000002)


   

3-Pyridinecarboxylic acid, 1,2-dihydro-2-thioxo-, Methyl ester

3-Pyridinecarboxylic acid, 1,2-dihydro-2-thioxo-, Methyl ester

C7H7NO2S (169.0197482)


   

methyl 6-sulfanylidene-1H-pyridine-3-carboxylate

methyl 6-sulfanylidene-1H-pyridine-3-carboxylate

C7H7NO2S (169.0197482)


   
   

1-H-Pyrazole-3-methaneamine dihydrochloride

1-H-Pyrazole-3-methaneamine dihydrochloride

C4H9Cl2N3 (169.0173494)


   

3-Fluoro-5-Nitrobenzaldehyde

3-Fluoro-5-Nitrobenzaldehyde

C7H4FNO3 (169.0175206)


   

4-methylsulfanylpyridine-2-carboxylic acid

4-methylsulfanylpyridine-2-carboxylic acid

C7H7NO2S (169.0197482)


   
   

9H-Purin-6-amine,8-chloro-

9H-Purin-6-amine,8-chloro-

C5H4ClN5 (169.0155214)


   

4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-6-amine

4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-6-amine

C5H4ClN5 (169.0155214)


   

2-cyclopropylthiazole-4-carboxylic acid

2-cyclopropylthiazole-4-carboxylic acid

C7H7NO2S (169.0197482)


   

4-Amino-5-Methylimidazole Dihydrochloride

4-Amino-5-Methylimidazole Dihydrochloride

C4H9Cl2N3 (169.0173494)


   

5-nitropyrimidine-2-carboxylicacid

5-nitropyrimidine-2-carboxylicacid

C5H3N3O4 (169.0123558)


   

7-Chloro-Imidazo[1,2-C]Pyrimidin-5-Ol

7-Chloro-Imidazo[1,2-C]Pyrimidin-5-Ol

C6H4ClN3O (169.00428839999998)


   

[2(Formyl-hydroxy-amino)-ethyl]-phosphonic acid

[2(Formyl-hydroxy-amino)-ethyl]-phosphonic acid

C3H8NO5P (169.0140088)


   

Diethylthiophosphate

Diethylthiophosphate

C4H10O3PS- (169.008826)


   

3,4,5-Trihydroxybenzoate

3,4,5-Trihydroxybenzoate

C7H5O5- (169.013698)


   
   

3,5-Didehydroshikimate

3,5-Didehydroshikimate

C7H5O5- (169.013698)


   

Phloroglucinol carboxylate

Phloroglucinol carboxylate

C7H5O5- (169.013698)


   

2,4,5-Trihydroxybenzoate

2,4,5-Trihydroxybenzoate

C7H5O5- (169.013698)


   

3-Formyl-2-hydroxymuconate semialdehyde

3-Formyl-2-hydroxymuconate semialdehyde

C7H5O5- (169.013698)


   

glyphosate

N-Phosphonomethyl-glycine

C3H8NO5P (169.0140088)


D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D004791 - Enzyme Inhibitors > D014475 - Uncoupling Agents D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

DL-AP3

2-Amino-3-phosphonopropionic acid

C3H8NO5P (169.0140088)


D018377 - Neurotransmitter Agents > D018683 - Excitatory Amino Acid Agents > D018691 - Excitatory Amino Acid Antagonists DL-AP3 is a competitive mGluR1 and mGluR5 antagonist. DL-AP3 is also an inhibitor of phosphoserine phosphatase. DL-AP3 has neuroprotective effect[1][2][3].

   

furoic acid

L-Cysteic acid

C3H7NO5S (169.00449319999998)


The L-enantiomer of cysteic acid.

   

O,O-Diethyl thiophosphate

O,O-Diethyl thiophosphate

C4H10O3PS (169.008826)


An organic phosphorothioate anion that is the conjugate base of O,O-diethyl hydrogen thiophosphate, resulting from the deprotonation of the thiophosphate group. Major species at pH 7.3.

   

4-Chlorophenylacetate

4-Chlorophenylacetate

C8H6ClO2 (169.00563060000002)


A monocarboxylic acid anion that results from the removal of a proton from the carboxylic acid group of 4-chlorophenylacetic acid.

   

2-Amino-3-phosphonopropanoic acid

2-Amino-3-phosphonopropanoic acid

C3H8NO5P (169.0140088)


A non-proteinogenc alpha-amino acid that is alanine in which one of the hydrogens of the terminal methyl group has been replaced by a dihydroxy(oxido)-lambda(5)-phosphanyl group.

   

gallate

gallate

C7H5O5 (169.013698)


A trihydroxybenzoate that is the conjugate base of gallic acid.

   

Aminooxopropyl phosphate

Aminooxopropyl phosphate

C3H8NO5P (169.0140088)


   

5-hydroxycampsiside

NA

C3H8NO5P (169.0140088)


{"Ingredient_id": "HBIN011678","Ingredient_name": "5-hydroxycampsiside","Alias": "NA","Ingredient_formula": "C3H8NO5P","Ingredient_Smile": "C(C(=O)COP(=O)(O)O)N","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32282","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}