Exact Mass: 861.1206838
Exact Mass Matches: 861.1206838
Found 25 metabolites which its exact mass value is equals to given mass value 861.1206838,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
beta-ketovaleryl-CoA
beta-ketovaleryl-coa is a member of the class of compounds known as 3-oxo-acyl coas. 3-oxo-acyl coas are organic compounds containing a 3-oxo acylated coenzyme A derivative. beta-ketovaleryl-coa is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). beta-ketovaleryl-coa can be found in a number of food items such as gooseberry, olive, cucurbita (gourd), and red raspberry, which makes beta-ketovaleryl-coa a potential biomarker for the consumption of these food products.
(Methylenecyclopropyl)acetyl-CoA
C27H42N7O17P3S (861.1570672000001)
beta-ketovaleryl-CoA
beta-ketovaleryl-coa is a member of the class of compounds known as 3-oxo-acyl coas. 3-oxo-acyl coas are organic compounds containing a 3-oxo acylated coenzyme A derivative. beta-ketovaleryl-coa is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). beta-ketovaleryl-coa can be found in a number of food items such as gooseberry, olive, cucurbita (gourd), and red raspberry, which makes beta-ketovaleryl-coa a potential biomarker for the consumption of these food products. β-ketovaleryl-coa is a member of the class of compounds known as 3-oxo-acyl coas. 3-oxo-acyl coas are organic compounds containing a 3-oxo acylated coenzyme A derivative. β-ketovaleryl-coa is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). β-ketovaleryl-coa can be found in a number of food items such as gooseberry, olive, cucurbita (gourd), and red raspberry, which makes β-ketovaleryl-coa a potential biomarker for the consumption of these food products.
[5-(6-Aminopurin-9-yl)-4-hydroxy-2-[[[[3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[2-(3-oxopentanoylsulfanyl)ethylamino]propyl]amino]butoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]oxolan-3-yl] phosphate
C26H38N7O18P3S-4 (861.1206838)
2-methylacetoacetyl-CoA(4-)
C26H38N7O18P3S-4 (861.1206838)
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trans,trans-2,4-hexadienoyl-CoA
C27H42N7O17P3S (861.1570672000001)
A trans,trans-2,3,4,5-tetradehydroacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of trans,trans-2,4-hexadienoic acid.
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 2-(2-methylidenecyclopropyl)ethanethioate
C27H42N7O17P3S (861.1570672000001)
(1S)-(Methylenecyclopropyl)acetyl-CoA
C27H42N7O17P3S (861.1570672000001)
(1R)-(Methylenecyclopropyl)acetyl-CoA
C27H42N7O17P3S (861.1570672000001)
Methylenecyclopropyl acetyl-CoA; (Acyl-CoA); [M+H]+
C27H42N7O17P3S (861.1570672000001)
2-methylacetoacetyl-CoA(4-)
An acyl-CoA(4-) that is the tetraanion of 2-methylacetoacetyl-CoA, arising from deprotonation of phosphate and diphosphate functions.
4-methylpentanoyl-CoA(4-)
C27H42N7O17P3S (861.1570672000001)
A methyl-branched fatty acyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate OH groups of 4-methylpentanoyl-CoA; major species at pH 7.3.
hexanoyl-CoA(4-)
C27H42N7O17P3S (861.1570672000001)
An acyl-CoA(4-) oxoanion arising from deprotonation of the phosphate and diphosphate OH groups of hexanoyl-CoA; major species at pH 7.3.
{[(2r,3s,8r,13r,14s,19r)-19-(4-bromobutyl)-8-(4,4-dibromobutyl)-10,13,21,24,26-pentahydroxy-3,14-dimethyltricyclo[18.2.2.2⁹,¹²]hexacosa-1(22),9,11,20,23,25-hexaen-2-yl]oxy}methanimidic acid
C37H54Br3NO7 (861.1450153999999)
{[19-(4-bromobutyl)-8-(4,4-dibromobutyl)-10,13,21,24,26-pentahydroxy-3,14-dimethyltricyclo[18.2.2.2⁹,¹²]hexacosa-1(22),9,11,20,23,25-hexaen-2-yl]oxy}methanimidic acid
C37H54Br3NO7 (861.1450153999999)