Exact Mass: 322.0565

Exact Mass Matches: 322.0565

Found 89 metabolites which its exact mass value is equals to given mass value 322.0565, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Thymidine-5'-monophosphoric acid

{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphonic acid

C10H15N2O8P (322.0566)


5-Thymidylic acid (conjugate base thymidylate), also known as thymidine monophosphate (TMP), deoxythymidine monophosphate (dTMP), or deoxythymidylic acid (conjugate base deoxythymidylate), is a nucleotide that is used as a monomer in DNA. It is an ester of phosphoric acid with the nucleoside thymidine. dTMP consists of a phosphate group, the pentose sugar deoxyribose, and the nucleobase thymine. Unlike the other deoxyribonucleotides, thymidine monophosphate often does not contain the "deoxy" prefix in its name; nevertheless, its symbol often includes a "d" ("dTMP"). 5-Thymidylic acid belongs to the class of organic compounds known as pyrimidine 2-deoxyribonucleoside monophosphates. These are pyrimidine nucleotides with a monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2. The neutral species of 5-Thymidylic acid (2-deoxythymidine 5-monophosphate). 5-Thymidylic acid exists in all living species, ranging from bacteria to humans. Within humans, 5-thymidylic acid participates in a number of enzymatic reactions. In particular, 5-thymidylic acid and dihydrofolic acid can be biosynthesized from dUMP and 5,10-methylene-THF by the enzyme thymidylate synthase. In addition, 5-thymidylic acid can be converted into dTDP; which is catalyzed by the enzyme thymidylate synthase. In humans, 5-thymidylic acid is involved in pyrimidine metabolism. Outside of the human body, 5-Thymidylic acid has been detected, but not quantified in several different foods, such as common buckwheats, corn salad, garden cress, squashberries, and star fruits. 5-thymidylic acid, also known as thymidylate or thymidine 5-phosphate, is a member of the class of compounds known as pyrimidine 2-deoxyribonucleoside monophosphates. Pyrimidine 2-deoxyribonucleoside monophosphates are pyrimidine nucleotides with a monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2. 5-thymidylic acid is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 5-thymidylic acid can be found in a number of food items such as burbot, enokitake, scarlet bean, and garland chrysanthemum, which makes 5-thymidylic acid a potential biomarker for the consumption of these food products. 5-thymidylic acid can be found primarily in feces, as well as in human fibroblasts tissue. 5-thymidylic acid exists in all living species, ranging from bacteria to humans. In humans, 5-thymidylic acid is involved in the pyrimidine metabolism. 5-thymidylic acid is also involved in few metabolic disorders, which include beta ureidopropionase deficiency, dihydropyrimidinase deficiency, MNGIE (mitochondrial neurogastrointestinal encephalopathy), and UMP synthase deficiency (orotic aciduria). Acquisition and generation of the data is financially supported in part by CREST/JST.

   

L-gamma-Glutamyl-S-allylthio-L-cysteine

2-Amino-4-{[1-carboxy-2-(prop-2-en-1-yldisulphanyl)ethyl]-C-hydroxycarbonimidoyl}butanoic acid

C11H18N2O5S2 (322.0657)


N-gamma-Glutamyl-S-(allylthio)cysteine is found in onion-family vegetables. N-gamma-Glutamyl-S-(allylthio)cysteine is a constituent of garlic (Allium sativum). Constituent of garlic (Allium sativum). L-gamma-Glutamyl-S-allylthio-L-cysteine is found in garlic, soft-necked garlic, and onion-family vegetables.

   

7,7'-Dihydroxy-6,8'-bicoumarin

7-hydroxy-6-(7-hydroxy-2-oxo-2H-chromen-8-yl)-2H-chromen-2-one

C18H10O6 (322.0477)


7,7-Dihydroxy-6,8-bicoumarin is found in herbs and spices. 7,7-Dihydroxy-6,8-bicoumarin is isolated from white clover (Trifolium repens). Isolated from white clover (Trifolium repens). 7,7-Dihydroxy-6,8-bicoumarin is found in tea, herbs and spices, and pulses.

   

thymidine 3'-monophosphate

{[5-(4-hydroxy-5-methyl-2-oxo-1,2-dihydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid

C10H15N2O8P (322.0566)


thymidine 3-monophosphate is considered to be soluble (in water) and acidic

   

N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide

N-{6-chloro-9H-pyrido[3,4-b]indol-8-yl}pyridine-3-carboximidate

C17H11ClN4O (322.0621)


   

Saxalin

4-(3-chloro-2-hydroxy-3-methylbutoxy)-7H-furo[3,2-g]chromen-7-one

C16H15ClO5 (322.0608)


Saxalin is a member of the class of compounds known as psoralens. Psoralens are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one. Saxalin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Saxalin can be found in parsley, which makes saxalin a potential biomarker for the consumption of this food product.

   
   

2,7,8-Trihydroxy-3-phenyl-1,4-dibenzofurandione

2,7,8-Trihydroxy-3-phenyl-1,4-dibenzofurandione

C18H10O6 (322.0477)


   

Isosaxalin

(+)-8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen

C16H15ClO5 (322.0608)


   
   
   

7,7-Dihydroxy-3,8-biscoumarin

7,7-Dihydroxy-3,8-biscoumarin

C18H10O6 (322.0477)


   

2-(2-Furylcarbonyl)-3-[4-(trifluoromethoxy)anilino]acrylonitrile

2-(2-Furylcarbonyl)-3-[4-(trifluoromethoxy)anilino]acrylonitrile

C15H9F3N2O3 (322.0565)


   
   

16-bromo-(7E,15E)-hexadeca-7,15-dien-5,13-diynoic acid

16-bromo-(7E,15E)-hexadeca-7,15-dien-5,13-diynoic acid

C16H19BrO2 (322.0568)


   

Cymopochromenol

Cymopochromenol

C16H19BrO2 (322.0568)


   

2,7,8-Trihydroxy-3-phenyldibenzofuran-1,4-dione

2,7,8-Trihydroxy-3-phenyldibenzofuran-1,4-dione

C18H10O6 (322.0477)


   

Daphnogitin

Daphnogitin

C18H10O6 (322.0477)


   

(9E,15E)-form-16-Bromo-9,15-hexadecadiene-5,7-diynoic acid

(9E,15E)-form-16-Bromo-9,15-hexadecadiene-5,7-diynoic acid

C16H19BrO2 (322.0568)


   

DTXSID30952826

DTXSID30952826

C18H10O6 (322.0477)


   

8-hydroxy-7,7-oxydicoumarin

8-hydroxy-7,7-oxydicoumarin

C18H10O6 (322.0477)


   

7,5-dihydroxy-3,6-bicoumarinyl

7,5-dihydroxy-3,6-bicoumarinyl

C18H10O6 (322.0477)


   

3,4-methylenedioxy-[2,3:7,8]furanoflavonol

3,4-methylenedioxy-[2,3:7,8]furanoflavonol

C18H10O6 (322.0477)


   
   

Saxalin

7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(3-chloro-2-hydroxy-3-methylbutoxy)-

C16H15ClO5 (322.0608)


Saxalin is a natural product found in Harbouria trachypleura, Petroselinum crispum, and other organisms with data available.

   

7,7-Dihydroxy-3,8-biscoumain

7,7-Dihydroxy-3,8-biscoumain

C18H10O6 (322.0477)


   

(3R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone|(R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone

(3R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone|(R)-3-chloro-6-hydroxy-8-methoxy-alpha-lapachone

C16H15ClO5 (322.0608)


   

CHEMBL4517265

CHEMBL4517265

C15H14O6S (322.0511)


   

SAXAKIN

(+)-9-(3-Chloro-2-hydroxy-3-methylbutoxy)-7H-furo[3,2-g][1]benzopyran-7-one; 8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen; 8-(3-Chloro-2-hydroxy-3-methylbutyloxy)psoralen

C16H15ClO5 (322.0608)


   

5-Thymidylic acid

Thymidine-5-monophosphate

C10H15N2O8P (322.0566)


   

THYMIDINE 5-MONOPHOSPHATE

THYMIDINE 5-MONOPHOSPHATE

C10H15N2O8P (322.0566)


   

Thymidine 5-monophosphate

Thymidine 5-monophosphate

C10H15N2O8P (322.0566)


   

dTMP

dTMP

C10H15N2O8P (322.0566)


The neutral species of thymidine 5-monophosphate (2-deoxythymidine 5-monophosphate).

   

THYMIDINE 5'-MONOPHOSPHATE

THYMIDINE 5'-MONOPHOSPHATE

C10H15N2O8P (322.0566)


   

THYMIDINE-MONOPHOSPHATE

THYMIDINE-MONOPHOSPHATE

C10H15N2O8P (322.0566)


   

7,7'-Dihydroxy-6,8'-bicoumarin

7-hydroxy-8-(7-hydroxy-2-oxo-2H-chromen-6-yl)-2H-chromen-2-one

C18H10O6 (322.0477)


   

L-gamma-Glutamyl-S-allylthio-L-cysteine

2-amino-4-{[1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]carbamoyl}butanoic acid

C11H18N2O5S2 (322.0657)


   

GN25

GN25

C15H14O6S (322.0511)


GN25 is a specific p53-Snail binding inhibitor with antitumor effects[1].

   

16-bromo-7E,15E-hexadecadien-5,13-diynoic acid

16-bromo-7E,15E-hexadecadien-5,13-diynoic acid

C16H19BrO2 (322.0568)


   

1-(3-AMINO-4-CHLOROBENZENESULFONYL)-1,2,3,4-TETRAHYDROQUINOLINE

1-(3-AMINO-4-CHLOROBENZENESULFONYL)-1,2,3,4-TETRAHYDROQUINOLINE

C15H15ClN2O2S (322.0543)


   

Sulfaquinoxaline sodium salt

Sulfaquinoxaline sodium salt

C14H11N4NaO2S (322.05)


   

1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-5-AMINIUM CHLORIDE

1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-5-AMINIUM CHLORIDE

C15H15ClN2O2S (322.0543)


   

2-(2-[[(4-CHLOROPHENYL)THIO]METHYL]PHENOXY)ETHANOHYDRAZIDE

2-(2-[[(4-CHLOROPHENYL)THIO]METHYL]PHENOXY)ETHANOHYDRAZIDE

C15H15ClN2O2S (322.0543)


   
   

2,3-DIPHENYLTETRAZOLIUM PERCHLORATE

2,3-DIPHENYLTETRAZOLIUM PERCHLORATE

C13H11ClN4O4 (322.0469)


   

ethyl (E)-3-(2-chlorophenyl)-2-[(1,3-thiazol-2-ylamino)methyl]prop-2-enoate

ethyl (E)-3-(2-chlorophenyl)-2-[(1,3-thiazol-2-ylamino)methyl]prop-2-enoate

C15H15ClN2O2S (322.0543)


   

methyl 3-hydroxy-5-(4-methylsulfonylphenoxy)benzoate

methyl 3-hydroxy-5-(4-methylsulfonylphenoxy)benzoate

C15H14O6S (322.0511)


   

Diethyl tosyloxy methylphosphonate

Diethyl tosyloxy methylphosphonate

C12H19O6PS (322.064)


   

hydrindantin

hydrindantin

C18H10O6 (322.0477)


   

Cefazolin Sodium impurity G

Cefazolin Sodium impurity G

C11H10N6O4S (322.0484)


   
   

5-Bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

5-Bromo-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

C13H16BBrN2O2 (322.0488)


   

4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine

4-[3-(4-Chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine

C17H11ClN4O (322.0621)


   

4-Deoxy-4-acetylyamino-pyridoxal-5-phosphate

4-Deoxy-4-acetylyamino-pyridoxal-5-phosphate

C10H15N2O8P (322.0566)


   

6-Deoxyversicolorin A

6-Deoxyversicolorin A

C18H10O6 (322.0477)


   

N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide

N-(6-Chloro-9h-pyrido[3,4-b]indol-8-yl)-3-pyridinecarboxamide

C17H11ClN4O (322.0621)


   

10-(3-Aminopropyl)-8-chlorophenothiazine-2,3-diol

10-(3-Aminopropyl)-8-chlorophenothiazine-2,3-diol

C15H15ClN2O2S (322.0543)


D004791 - Enzyme Inhibitors > D000067956 - Adenylyl Cyclase Inhibitors

   

1-(2-deoxy-5-O-phosphono-beta-L-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione

1-(2-deoxy-5-O-phosphono-beta-L-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione

C10H15N2O8P (322.0566)


   

N-(4-chlorophenyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

N-(4-chlorophenyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

C15H15ClN2O2S (322.0543)


   

[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate

[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate

C10H15N2O8P (322.0566)


   

3-Thymidylic acid

3-Thymidylic acid

C10H15N2O8P (322.0566)


   

[4-[(3S)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]phenyl] hydrogen sulfate

[4-[(3S)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]phenyl] hydrogen sulfate

C15H14O6S (322.0511)


   

N-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-benzothiazole-2-carboxamide

N-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-benzothiazole-2-carboxamide

C16H10N4O2S (322.0524)


   

3-(4-chlorophenyl)-5-(3-phenyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole

3-(4-chlorophenyl)-5-(3-phenyl-1H-pyrazol-4-yl)-1,2,4-oxadiazole

C17H11ClN4O (322.0621)


   

2-[5-(3-chlorophenyl)furan-2-yl]quinazolin-4(3H)-one

2-[5-(3-chlorophenyl)furan-2-yl]quinazolin-4(3H)-one

C18H11ClN2O2 (322.0509)


   

(+/-)-Equol 4-sulfate (sodium salt)

(+/-)-Equol 4-sulfate (sodium salt)

C15H14O6S (322.0511)


   

{3-[3-(2-Hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid

{3-[3-(2-Hydroxyphenyl)propanoyl]phenyl}oxidanesulfonic acid

C15H14O6S (322.0511)


   

7,7-Dihydroxy-6,8-bicoumarin

7,7-Dihydroxy-6,8-bicoumarin

C18H10O6 (322.0477)


   

Azvudine (hydrochloride)

Azvudine (hydrochloride)

C9H12ClFN6O4 (322.0593)


Azvudine (RO-0622) hydrochloride is a potent nucleoside reverse transcriptase inhibitor (NRTI), with antiviral activity on HIV, HBV and HCV. Azvudine hydrochloride exerts highly potent inhibition on HIV-1 (EC50s ranging from 0.03 to 6.92 nM) and HIV-2 (EC50s ranging from 0.018 to 0.025 nM). Azvudine hydrochloride inhibits NRTI-resistant viral strains[1]. Azvudine (hydrochloride) is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. Strain-promoted alkyne-azide cycloaddition (SPAAC) can also occur with molecules containing DBCO or BCN groups.

   

Oxotremorine M (iodide)

Oxotremorine M (iodide)

C11H19IN2O (322.0542)


Oxotremorine M iodide is a potent and non-selective muscarinic acetylcholine receptor (mAChR) agonist. Oxotremorine M iodide potentiates NMDA receptors by muscarinic receptor dependent and independent mechanisms[1].

   

4-[(2r)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

4-[(2r)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

C16H15ClO5 (322.0608)


   

7-bromo-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol

7-bromo-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol

C16H19BrO2 (322.0568)


   

(2s)-2-amino-4-{[(1r)-1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]-c-hydroxycarbonimidoyl}butanoic acid

(2s)-2-amino-4-{[(1r)-1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]-c-hydroxycarbonimidoyl}butanoic acid

C11H18N2O5S2 (322.0657)


   

9-[(2r)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

9-[(2r)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

C16H15ClO5 (322.0608)


   

7-(2h-1,3-benzodioxol-5-yl)-4-hydroxyfuro[3,2-g]chromen-5-one

7-(2h-1,3-benzodioxol-5-yl)-4-hydroxyfuro[3,2-g]chromen-5-one

C18H10O6 (322.0477)


   

2-amino-4-{[1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]-c-hydroxycarbonimidoyl}butanoic acid

2-amino-4-{[1-carboxy-2-(prop-2-en-1-yldisulfanyl)ethyl]-c-hydroxycarbonimidoyl}butanoic acid

C11H18N2O5S2 (322.0657)


   

7-hydroxy-3-[(2-oxochromen-7-yl)oxy]chromen-2-one

7-hydroxy-3-[(2-oxochromen-7-yl)oxy]chromen-2-one

C18H10O6 (322.0477)


   

[3-hydroxy-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid

[3-hydroxy-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid

C10H15N2O8P (322.0566)


   

7,7'-dihydroxy-[3,8'-bichromene]-2,2'-dione

7,7'-dihydroxy-[3,8'-bichromene]-2,2'-dione

C18H10O6 (322.0477)


   

(3r)-3-chloro-6-hydroxy-8-methoxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione

(3r)-3-chloro-6-hydroxy-8-methoxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione

C16H15ClO5 (322.0608)


   

4,11,12-trihydroxy-5-phenyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2(7),4,9,11-pentaene-3,6-dione

4,11,12-trihydroxy-5-phenyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2(7),4,9,11-pentaene-3,6-dione

C18H10O6 (322.0477)


   

(2r)-7-bromo-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol

(2r)-7-bromo-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol

C16H19BrO2 (322.0568)


   

2-(2h-1,3-benzodioxol-5-yl)-3-hydroxyfuro[2,3-h]chromen-4-one

2-(2h-1,3-benzodioxol-5-yl)-3-hydroxyfuro[2,3-h]chromen-4-one

C18H10O6 (322.0477)


   

[(2r,3s,5r)-3-hydroxy-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid

[(2r,3s,5r)-3-hydroxy-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid

C10H15N2O8P (322.0566)


   

(2r,15z)-16-bromohexadec-15-en-3,5,13-triyne-1,2-diol

(2r,15z)-16-bromohexadec-15-en-3,5,13-triyne-1,2-diol

C16H19BrO2 (322.0568)


   

7,7'-dihydroxy-[6,6'-bichromene]-2,2'-dione

7,7'-dihydroxy-[6,6'-bichromene]-2,2'-dione

C18H10O6 (322.0477)


   

3-chloro-6-hydroxy-8-methoxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione

3-chloro-6-hydroxy-8-methoxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione

C16H15ClO5 (322.0608)


   

7,7'-dihydroxy-[6,8'-bichromene]-2,2'-dione

7,7'-dihydroxy-[6,8'-bichromene]-2,2'-dione

C18H10O6 (322.0477)


   

(2r,15e)-16-bromohexadec-15-en-3,5,13-triyne-1,2-diol

(2r,15e)-16-bromohexadec-15-en-3,5,13-triyne-1,2-diol

C16H19BrO2 (322.0568)