Exact Mass: 413.9254822

Exact Mass Matches: 413.9254822

Found 53 metabolites which its exact mass value is equals to given mass value 413.9254822, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

   

Haloxon

3-Chloro-4-methyl-2-oxo-2H-chromen-7-yl bis(2-chloroethyl) phosphoric acid

C14H14Cl3O6P (413.95935640000005)


C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent

   

D-myo-inositol (1,2,3) trisphosphate

(1S,2R,4S,5R)-2,3,4-Trihydroxy-5,6-bis(phosphonatooxy)cyclohexyl phosphoric acid

C6H9O15P3 (413.91543540000004)


D-myo-inositol (1,2,3) trisphosphate is soluble (in water) and an extremely strong acidic compound (based on its pKa). D-myo-inositol (1,2,3) trisphosphate can be found in a number of food items such as green zucchini, oxheart cabbage, mixed nuts, and purslane, which makes D-myo-inositol (1,2,3) trisphosphate a potential biomarker for the consumption of these food products.

   

D-myo-inositol (1,2,6) trisphosphate

(1R,2S,4R,5R)-2,3,4-trihydroxy-5,6-bis(phosphonatooxy)cyclohexyl phosphate

C6H9O15P3 (413.91543540000004)


D-myo-inositol (1,2,6) trisphosphate is soluble (in water) and an extremely strong acidic compound (based on its pKa). D-myo-inositol (1,2,6) trisphosphate can be found in a number of food items such as biscuit, angelica, rice, and sapodilla, which makes D-myo-inositol (1,2,6) trisphosphate a potential biomarker for the consumption of these food products.

   

D-myo-inositol (1,3,4)-trisphosphate

(1S,2R,3R,4S,5S,6S)-2,3,6-trihydroxy-4,5-bis(phosphonatooxy)cyclohexyl phosphate

C6H9O15P3 (413.91543540000004)


D-myo-inositol (1,3,4)-trisphosphate, also known as ins(1,3,4)p3 or inositol 1,3,4-trisphosphoric acid, is a member of the class of compounds known as inositol phosphates. Inositol phosphates are compounds containing a phosphate group attached to an inositol (or cyclohexanehexol) moiety. D-myo-inositol (1,3,4)-trisphosphate is soluble (in water) and an extremely strong acidic compound (based on its pKa). D-myo-inositol (1,3,4)-trisphosphate can be found in a number of food items such as vanilla, hyacinth bean, japanese pumpkin, and green bean, which makes D-myo-inositol (1,3,4)-trisphosphate a potential biomarker for the consumption of these food products.

   

D-myo-inositol (1,4,5)-trisphosphate

2,3,6-Trihydroxy-4,5-bis(phosphonatooxy)cyclohexyl phosphoric acid

C6H9O15P3 (413.91543540000004)


D-myo-inositol (1,4,5)-trisphosphate is a member of the class of compounds known as inositol phosphates. Inositol phosphates are compounds containing a phosphate group attached to an inositol (or cyclohexanehexol) moiety. D-myo-inositol (1,4,5)-trisphosphate is soluble (in water) and an extremely strong acidic compound (based on its pKa). D-myo-inositol (1,4,5)-trisphosphate can be found in a number of food items such as ginkgo nuts, linden, swamp cabbage, and eggplant, which makes D-myo-inositol (1,4,5)-trisphosphate a potential biomarker for the consumption of these food products.

   

D-myo-inositol (2,3,4) trisphosphate

2,3,4-Trihydroxy-5,6-bis(phosphonatooxy)cyclohexyl phosphoric acid

C6H9O15P3 (413.91543540000004)


D-myo-inositol (2,3,4) trisphosphate is soluble (in water) and an extremely strong acidic compound (based on its pKa). D-myo-inositol (2,3,4) trisphosphate can be found in a number of food items such as moth bean, lupine, oyster mushroom, and brazil nut, which makes D-myo-inositol (2,3,4) trisphosphate a potential biomarker for the consumption of these food products.

   

isoPFOA

isoPFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

5mPFOA

5mPFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

4mPFOA

4mPFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

3mPFOA

3mPFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

55m2PFOA

55m2PFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

(1R,5Z)-3-(1-acetoxybutyl)-4-bromo-5-(iodomethylidene)-2(5H)-furanone

(1R,5Z)-3-(1-acetoxybutyl)-4-bromo-5-(iodomethylidene)-2(5H)-furanone

C11H12BrIO4 (413.8963682)


   

2-Phenyl-3-(2,3-dibromo-4,5-dihydroxyphenyl)propanoic acid

2-Phenyl-3-(2,3-dibromo-4,5-dihydroxyphenyl)propanoic acid

C15H12Br2O4 (413.9102272)


   
   
   

Perfluorooctanoic acid

Perfluorooctanoic acid (PFOA)

C8HF15O2 (413.97370259999997)


Perfluorooctanoic acid is a fluoroalkanoic acid that is perfluorinated octanoic acid. It has a role as an environmental contaminant, a xenobiotic, a carcinogenic agent, a surfactant and an endocrine disruptor. It is functionally related to a perfluorooctane and an octanoic acid. Perfluorooctanoic Acid (PFOA) can cause cancer according to The National Toxicology Program. It can cause developmental toxicity according to The Environmental Protection Agency (EPA). Perfluorooctanoic acid (PFOA), also known as C8 and perfluorooctanoate, is a synthetic, stable perfluorinated carboxylic acid and fluorosurfactant. One industrial application is as a surfactant in the emulsion polymerization of fluoropolymers. It has been used in the manufacture of such prominent consumer goods as Teflon and Gore-Tex. PFOA has been manufactured since the 1940s in industrial quantities. It is also formed by the degradation of precursors such as some fluorotelomers. PFOA persists indefinitely in the environment. It is a toxicant and carcinogen in animals. PFOA has been detected in the blood of more than 98\% of the general US population in the low and sub-parts per billion range, and levels are higher in chemical plant employees and surrounding subpopulations. Exposure has been associated with increased cholesterol and uric acid levels, and recently higher serum levels of PFOA were found to be associated with increased risk of chronic kidney disease in the general United States population, consistent with earlier animal studies. This association was independent of confounders such as age, sex, race/ethnicity, body mass index, diabetes, hypertension, and serum cholesterol level. .

   

nPFOA

nPFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

44m2PFOA

44m2PFOA

C8HF15O2 (413.97370259999997)


Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong.

   

Diphenylditelluride

Diphenylditelluride

C12H10Te2 (413.890704)


   

2,7-Dibromo-9-phenyl-9H-fluoren-9-ol

2,7-Dibromo-9-phenyl-9H-fluoren-9-ol

C19H12Br2O (413.9254822)


   

1-(benzenesulfonyl)-3-iodo-5-methoxypyrrolo[2,3-b]pyridine

1-(benzenesulfonyl)-3-iodo-5-methoxypyrrolo[2,3-b]pyridine

C14H11IN2O3S (413.95351260000007)


   

1,3-Dibromo-7-tert-butylpyrene

1,3-Dibromo-7-tert-butylpyrene

C20H16Br2 (413.9618656)


   

Disiloxane,1,3-bis(iodomethyl)-1,1,3,3-tetramethyl-

Disiloxane,1,3-bis(iodomethyl)-1,1,3,3-tetramethyl-

C6H16I2OSi2 (413.88291860000004)


   

2,5-Bis(4-Bromophenyl)-p-xylene

2,5-Bis(4-Bromophenyl)-p-xylene

C20H16Br2 (413.9618656)


   
   

2,2,3,3,4,4,5,5,6,7,7,7-Dodecafluoro-6-(trifluoromethyl)heptanoic acid

2,2,3,3,4,4,5,5,6,7,7,7-Dodecafluoro-6-(trifluoromethyl)heptanoic acid

C8HF15O2 (413.97370259999997)


   

2,2,3,3,4,4,6,6,6-Nonafluoro-5,5-bis(trifluoromethyl)hexanoic acid

2,2,3,3,4,4,6,6,6-Nonafluoro-5,5-bis(trifluoromethyl)hexanoic acid

C8HF15O2 (413.97370259999997)


   

2,2,3,3,4,4,5,6,6,7,7,7-Dodecafluoro-5-(trifluoromethyl)heptanoic acid

2,2,3,3,4,4,5,6,6,7,7,7-Dodecafluoro-5-(trifluoromethyl)heptanoic acid

C8HF15O2 (413.97370259999997)


   

2,2,3,4,4,5,5,6,6,7,7,7-Dodecafluoro-3-(trifluoromethyl)heptanoic acid

2,2,3,4,4,5,5,6,6,7,7,7-Dodecafluoro-3-(trifluoromethyl)heptanoic acid

C8HF15O2 (413.97370259999997)


   

2,2,3,3,4,5,5,6,6,7,7,7-Dodecafluoro-4-(trifluoromethyl)heptanoic acid

2,2,3,3,4,5,5,6,6,7,7,7-Dodecafluoro-4-(trifluoromethyl)heptanoic acid

C8HF15O2 (413.97370259999997)


   

2,2,3,3,5,5,6,6,6-Nonafluoro-4,4-bis(trifluoromethyl)hexanoic acid

2,2,3,3,5,5,6,6,6-Nonafluoro-4,4-bis(trifluoromethyl)hexanoic acid

C8HF15O2 (413.97370259999997)


   
   
   
   

1D-myo-inositol 1,3,4-trisphosphate(6-)

1D-myo-inositol 1,3,4-trisphosphate(6-)

C6H9O15P3-6 (413.91543540000004)


   
   

(2,3,4-Trihydroxy-5,6-diphosphonatooxycyclohexyl) phosphate

(2,3,4-Trihydroxy-5,6-diphosphonatooxycyclohexyl) phosphate

C6H9O15P3-6 (413.91543540000004)


   

1D-myo-inositol 1,4,5-trisphosphate(6-)

1D-myo-inositol 1,4,5-trisphosphate(6-)

C6H9O15P3-6 (413.91543540000004)


   
   
   
   
   

5-bromo-N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-N-methyl-2-thiophenesulfonamide

5-bromo-N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-N-methyl-2-thiophenesulfonamide

C15H15BrN2O3S2 (413.97074200000003)


   

1D-myo-inositol 1,3,4-trisphosphate(6-)

1D-myo-inositol 1,3,4-trisphosphate(6-)

C6H9O15P3 (413.91543540000004)


The hexaanion of 1D-myo-inositol 1,3,4-trisphosphate.

   

1D-myo-inositol 1,4,5-trisphosphate(6-)

1D-myo-inositol 1,4,5-trisphosphate(6-)

C6H9O15P3 (413.91543540000004)


Hexaanion of 1D-myo-inositol 1,4,5-trisphosphate arising from glabal deprotonation of the phosphate OH groups; major species at pH 7.3.

   

(1r)-1-[(5z)-4-bromo-5-(iodomethylidene)-2-oxofuran-3-yl]butyl acetate

(1r)-1-[(5z)-4-bromo-5-(iodomethylidene)-2-oxofuran-3-yl]butyl acetate

C11H12BrIO4 (413.8963682)


   

(2r)-3-(2,3-dibromo-4,5-dihydroxyphenyl)-2-phenylpropanoic acid

(2r)-3-(2,3-dibromo-4,5-dihydroxyphenyl)-2-phenylpropanoic acid

C15H12Br2O4 (413.9102272)


   

3-(2,3-dibromo-4,5-dihydroxyphenyl)-2-phenylpropanoic acid

3-(2,3-dibromo-4,5-dihydroxyphenyl)-2-phenylpropanoic acid

C15H12Br2O4 (413.9102272)


   

1-[4-bromo-5-(iodomethylidene)-2-oxofuran-3-yl]butyl acetate

1-[4-bromo-5-(iodomethylidene)-2-oxofuran-3-yl]butyl acetate

C11H12BrIO4 (413.8963682)