Exact Mass: 847.1050346000001

Exact Mass Matches: 847.1050346000001

Found 25 metabolites which its exact mass value is equals to given mass value 847.1050346000001, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

2-methylbutanoyl-CoA

4-({[({[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonatooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-3,3-dimethyl-N-[2-({2-[(2-methylbutanoyl)sulphanyl]ethyl}carboximidato)ethyl]butanecarboximidic acid

C26H40N7O17P3S (847.141418)


2-methylbutanoyl-coa is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). 2-methylbutanoyl-coa can be found in a number of food items such as flaxseed, irish moss, chickpea, and black cabbage, which makes 2-methylbutanoyl-coa a potential biomarker for the consumption of these food products.

   
   

4-pentynoyl-Coenzyme A

S-4-pentynoate coenzyme A

C26H40N7O17P3S (847.141418)


   

isovaleryl-CoA(4-)

isovaleryl-CoA(4-)

C26H40N7O17P3S-4 (847.141418)


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acetoacetyl-CoA(4-)

acetoacetyl-CoA(4-)

C25H36N7O18P3S-4 (847.1050346000001)


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[5-(6-Aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethyl-4-[[3-[2-(2-methylbutanoylsulfanyl)ethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate

[5-(6-Aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethyl-4-[[3-[2-(2-methylbutanoylsulfanyl)ethylamino]-3-oxopropyl]amino]-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate

C26H40N7O17P3S-4 (847.141418)


   

2-methylbutanoyl-CoA(4-)

2-methylbutanoyl-CoA(4-)

C26H40N7O17P3S-4 (847.141418)


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CHEBI:17157; (Acyl-CoA); [M+H]+

CHEBI:17157; (Acyl-CoA); [M+H]+

C26H40N7O17P3S (847.141418)


   

3,4-Pentadienoyl-CoA; (Acyl-CoA); [M+H]+

3,4-Pentadienoyl-CoA; (Acyl-CoA); [M+H]+

C26H40N7O17P3S (847.141418)


   

CID10010773; (Acyl-CoA); [M+H]+

CID10010773; (Acyl-CoA); [M+H]+

C26H40N7O17P3S (847.141418)


   

Tritium-CID10509761-CoA; (Acyl-CoA); [M+H]+

Tritium-CID10509761-CoA; (Acyl-CoA); [M+H]+

C26H40N7O17P3S (847.141418)


   

13C-CID10952954-CoA; (Acyl-CoA); [M+H]+

13C-CID10952954-CoA; (Acyl-CoA); [M+H]+

C26H40N7O17P3S (847.141418)


   

PubChem CID: 22144953; (Acyl-CoA); [M+H]+

PubChem CID: 22144953; (Acyl-CoA); [M+H]+

C26H40N7O17P3S (847.141418)


   

isovaleryl-CoA(4-)

isovaleryl-CoA(4-)

C26H40N7O17P3S (847.141418)


A short chain fatty acyl-CoA(4-) that is the tetraanion of isovaleryl-CoA arising from deprotonation of phosphate and diphosphate functions.

   

pentanoyl-CoA(4-)

pentanoyl-CoA(4-)

C26H40N7O17P3S (847.141418)


An acyl-CoA(4-) that is the tetranion of pentanoyl-CoA, arising from deprotonation of phosphate and diphosphate functions.

   

(S)-2-methylbutanoyl-CoA(4-)

(S)-2-methylbutanoyl-CoA(4-)

C26H40N7O17P3S (847.141418)


A 2-methylbutanoyl-CoA(4-) obtained by deprotonation of phosphate and diphosphate functions of (S)-2-methylbutanoyl-CoA; major species at pH 7.3.

   

pivaloyl-CoA(4-)

pivaloyl-CoA(4-)

C26H40N7O17P3S (847.141418)


A short chain fatty acyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate OH groups of pivaloyl-CoA; major species at pH 7.3.

   

2-methylbutanoyl-CoA(4-)

2-methylbutanoyl-CoA(4-)

C26H40N7O17P3S (847.141418)


A short chain fatty acyl-CoA(4-) that is the tetraanion of 2-methylbutanoyl-CoA, arising from deprotonation of phosphate and diphosphate functions.

   

acetoacetyl-CoA(4-)

acetoacetyl-CoA(4-)

C25H36N7O18P3S (847.1050346000001)


A 3-oxoacyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate OH groups of acetoacetyl-CoA.