Exact Mass: 80.0595

Exact Mass Matches: 80.0595

Found 55 metabolites which its exact mass value is equals to given mass value 80.0595, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Pyrimidine

Pyrimidine dimer

C4H4N2 (80.0374)


Pyrimidine is a heterocyclic aromatic organic compound similar to benzene and pyridine, containing two nitrogen atoms at positions 1 and 3 of the six-member ring. Pyrimidines are heterocyclic, six-membered, nitrogen-containing carbon ring structures, with uracil, cytosine and thymine being the basal structures of ribose-containing nucleosides (uridine, cytidine and thymidine respectively), or deoxyribose-containing deoxynucleosides, and their corresponding ribonucleotides or deoxyribonucleotides. Pyrimidines serve essential functions in human metabolism as ribonucleotide bases in RNA (uracil and cytosine), and as deoxyribonucleotide bases in DNA (cytosine and thymine), and are linked by phosphodiester bridges to purine nucleotides in double-stranded DNA, in both the nucleus and the mitochondria. Pyrimidine activated sugars are also involved in polysaccharide and phospholipid synthesis, glucuronidation in detoxification processes, glycosylation of proteins and lipids and in the recently identified novel endothelium-derived vasoactive dinucleotides. Pyrimidines are synthesized de novo from simple precursors. Synthesis occurs in six steps, with cellular compartmentalization of specific steps in the cytosol or mitochondria, enabling changes in metabolic rate with need. Pyrimidine synthesis differs from purine synthesis, in that the single pyrimidine ring is assembled first and is then linked to ribose phosphate to form UMP. The enzymes that catalyse UMP synthesis, CAD [carbamoylphosphate synthetase II (CPSII), aspartate transcarbamoylase (ATCasea) and dihydroorotase (DHOase)], dihydroorotate dehydrogenase (DHODH) and uridine monophosphate synthase (UMPS), are encoded by only three genes - CAD, DHODH and UMPS (chromosomal locations 2p21, 16q22 and 3q13, respectively). (PMID:16098809). Pyrimidine is a heterocyclic aromatic organic compound similar to benzene and pyridine, containing two nitrogen atoms at positions 1 and 3 of the six-member ring. Pyrimidines are heterocyclic, six-membered, nitrogen-containing carbon ring structures, with uracil, cytosine and thymine being the basal structures of ribose-containing nucleosides (uridine, cytidine and thymidine respectively), or deoxyribose-containing deoxynucleosides, and their corresponding ribonucleotides or deoxyribonucleotides. Pyrimidines serve essential functions in human metabolism as ribonucleotide bases in RNA (uracil and cytosine), and as deoxyribonucleotide bases in DNA (cytosine and thymine), and are linked by phosphodiester bridges to purine nucleotides in double-stranded DNA, in both the nucleus and the mitochondria. Pyrimidine activated sugars are also involved in polysaccharide and phospholipid synthesis, glucuronidation in detoxification processes, glycosylation of proteins and lipids and in the recently identified novel endothelium-derived vasoactive dinucleotides. Pyrimidine is an endogenous metabolite.

   

Pyrazine

1, 4-Diazabenzene

C4H4N2 (80.0374)


Pyrazine is found in fenugreek. Pyrazine is a maillard product In the Staedel-Rugheimer pyrazine synthesis (1876) 2-chloroacetophenone is reacted with ammonia to the amino ketone, then condensed and then oxidized to a pyrazine A variation is the Gutknecht Pyrazine Synthesis (1879) also based on this selfcondensation but differing in the way the alpha-ketoamine is synthesised (the chlorine compound in the above method is a lachrymatory agent); Pyrazine is a heterocyclic aromatic organic compound. Pyrazine is a symmetrical molecule with point group D2h. It is found in folic acid in the form of pterin. Derivatives like Phenazine are well known for their antitumor, antibiotic and diuretic activity. Pyrazine is less basic in nature than pyridine, pyridazine and pyrimidine. Tetramethylpyrazine (also known as ligustrazine) is reported to scavenge superoxide anion and decrease nitric oxide production in human polymorphonuclear leukocytes. Tetramethylpyrazine is also a component of some herbs in Traditional Chinese Medicine. Maillard product

   

1,3,5-Hexatriene

hexa-1,3,5-triene

C6H8 (80.0626)


   

Methylene-imidazole

2-methylidene-2H-imidazole

C4H4N2 (80.0374)


   

Pyridazin

1,2-Diazabenzene

C4H4N2 (80.0374)


   

Succinonitrile

butanedinitrile

C4H4N2 (80.0374)


   

Tricyclo[1.1.0.02,4]butane-1-carbaldehyde

tricyclo[1.1.0.0^{2,4}]butane-1-carbaldehyde

C5H4O (80.0262)


   

Dinitrile-Succinic acid,

Dinitrile-Succinic acid,

C4H4N2 (80.0374)


   

1,3-cyclohexdiene

1,3-CYCLOHEXADIENE

C6H8 (80.0626)


   

PYRIMIDINE

PYRIMIDINE

C4H4N2 (80.0374)


The parent compound of the pyrimidines; a diazine having the two nitrogens at the 1- and 3-positions. Pyrimidine is an endogenous metabolite.

   

Methylcyclopenta-1,3-diene

Methylcyclopenta-1,3-diene

C6H8 (80.0626)


   

pyridine-4-d1

pyridine-4-d1

C5H4DN (80.0485)


   

n-butyraldehyde-d8

n-butyraldehyde-d8

C4D8O (80.1077)


   

2-METHYL-1-PENTEN-3-YNE

2-METHYL-1-PENTEN-3-YNE

C6H8 (80.0626)


   

1-HEXEN-4-YNE

1-HEXEN-4-YNE

C6H8 (80.0626)


   

2-(2H8)Butanone

2-(2H8)Butanone

C4D8O (80.1077)


   

Formimidamide hydrochloride

Formimidamide hydrochloride

CH5ClN2 (80.0141)


   

Succinonitrile

Succinonitrile

C4H4N2 (80.0374)


   

(1,3-2H2)Benzene

(1,3-2H2)Benzene

C6H4D2 (80.0595)


   

methylurea-d6

methylurea-d6

C2D6N2O (80.0857)


   

1,4-Pentadiyn-3-ol

1,4-Pentadiyn-3-ol

C5H4O (80.0262)


   

(1,4-2H2)Benzene

(1,4-2H2)Benzene

C6H4D2 (80.0595)


   

d8-tetrahydrofuran

d8-tetrahydrofuran

C4D8O (80.1077)


   

1-HEXEN-3-YNE

1-HEXEN-3-YNE

C6H8 (80.0626)


   

Lithium tert-butoxide

Lithium tert-butoxide

C4H9LiO (80.0813)


   

thiourea-d4

thiourea-d4

CD4N2S (80.0346)


   

1,3,5-HEXATRIENE

1,3,5-HEXATRIENE

C6H8 (80.0626)


   

1,3-difluoropropane

1,3-difluoropropane

C3H6F2 (80.0438)


   

N-(2H3)Methyl-N-nitroso(2H3)methanamine

N-(2H3)Methyl-N-nitroso(2H3)methanamine

C2D6N2O (80.0857)


   

1-chloropropane-1,1-d2

1-chloropropane-1,1-d2

C3H5ClD2 (80.0362)


   

1-methylcyclopentadiene

1-methylcyclopentadiene

C6H8 (80.0626)


   

15N ammonium salt

15N ammonium salt

H4N2O3 (80.0222)


   

azane,nitric acid

azane,nitric acid

H4N2O3 (80.0222)


   

2-methylmalononitrile

2-methylmalononitrile

C4H4N2 (80.0374)


   

nitroethane-d5

nitroethane-d5

C2D5NO2 (80.0634)


   

Pyridazine

Pyridazine

C4H4N2 (80.0374)


   

1,2-Difluoropropane

1,2-Difluoropropane

C3H6F2 (80.0438)


   

N,2,2,2-tetradeuterio-N-(trideuteriomethyl)acetamide

N,2,2,2-tetradeuterio-N-(trideuteriomethyl)acetamide

C3D7NO (80.0967)


   

2,2-difluoropropane

2,2-difluoropropane

C3H6F2 (80.0438)


   

(1,2-2H2)Benzene

(1,2-2H2)Benzene

C6H4D2 (80.0595)


   

Ammonium nitrate -15N2

Ammonium nitrate -15N2

H4N2O3 (80.0222)


   

Ammonium nitrate

Ammonium nitrate

H4N2O3 (80.0222)


D016573 - Agrochemicals > D005308 - Fertilizers D053834 - Explosive Agents

   

propionic acid-d6

propionic acid-d6

C3D6O2 (80.0744)


   

dimethylformamide

dimethylformamide

C3D7NO (80.0967)


   

Glycine-d5

Glycine-d5

C2D5NO2 (80.0634)


A deuterated compound that is is an isotopologue of glycine in which all five hydrogen atoms have been replaced by deuterium.

   

1,1-Bi(cyclopropylidene)

1,1-Bi(cyclopropylidene)

C6H8 (80.0626)


   

1,4-Cyclohexadiene

1,4-Cyclohexadiene

C6H8 (80.0626)


   

2-Methoxy(2H4)ethanol

2-Methoxy(2H4)ethanol

C3H4D4O2 (80.0775)


   

5-Methyl-1,3-cyclopentadiene

5-Methyl-1,3-cyclopentadiene

C6H8 (80.0626)


   

Lithium borate

Lithium borate

BLi3O3 (80.0421)


   

Cyclohexa-1,2-diene

Cyclohexa-1,2-diene

C6H8 (80.0626)


   

2-Chloroethylaminium

2-Chloroethylaminium

C2H7ClN+ (80.0267)


   

PYRAZINE

PYRAZINE

C4H4N2 (80.0374)


A diazine that is benzene in which the carbon atoms at positions 1 and 4 have been replaced by nitrogen atoms.

   

2-oxabicyclo[3.1.0]hexa-1(5),3-diene

2-oxabicyclo[3.1.0]hexa-1(5),3-diene

C5H4O (80.0262)


   

3-methylidenecyclopent-1-ene

3-methylidenecyclopent-1-ene

C6H8 (80.0626)