Exact Mass: 129.0246

Exact Mass Matches: 129.0246

Found 75 metabolites which its exact mass value is equals to given mass value 129.0246, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Cyanuric acid

1,3,5-Triazine-2,4,6-triol (acd/name 4.0)

C3H3N3O3 (129.0174)


Because of their trifunctionality, CYA is a precursor to crosslinking agents, especially for polyurethane resins. Cyanuric acid or 1,3,5-triazine-2,4,6-triol is a chemical compound with the formula (CNOH)3. Like many industrially useful chemicals, this triazine has many synonyms. This white, odorless solid finds use as a precursor or a component of bleaches, disinfectants, and herbicides. In 1997, worldwide production was 160 million kilograms.

   

goitrin

goitrin

C5H7NOS (129.0248)


D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D013956 - Antithyroid Agents D000890 - Anti-Infective Agents > D023303 - Oxazolidinones CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2335 INTERNAL_ID 2335; CONFIDENCE Reference Standard (Level 1)

   

Flucytosine

Flucytosine (5-FC)

C4H4FN3O (129.0338)


J - Antiinfectives for systemic use > J02 - Antimycotics for systemic use > J02A - Antimycotics for systemic use D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent D009676 - Noxae > D000963 - Antimetabolites CONFIDENCE standard compound; EAWAG_UCHEM_ID 3121 CONFIDENCE standard compound; INTERNAL_ID 2239 Flucytosine (5-Fluorocytosine) is an antifungal compound with oral activity. Flucytosine is a widely used cytotoxic drug that, after further metabolism, produces fluorinated ribonucleotides and deoxyribonucleotides, inhibits DNA and protein synthesis, and has multiple effects such as inhibiting candida and candida neoplasm infection and producies cytotoxicity to cancer cells[1][2][3].

   

Flucytosine

6-amino-5-fluoro-1,2-dihydropyrimidin-2-one

C4H4FN3O (129.0338)


Flucytosine is only found in individuals that have used or taken this drug. It is a fluorinated cytosine analog that is used as an antifungal agent. [PubChem]Although the exact mode of action is unknown, it has been proposed that flucytosine acts directly on fungal organisms by competitive inhibition of purine and pyrimidine uptake and indirectly by intracellular metabolism to 5-fluorouracil. Flucytosine enters the fungal cell via cytosine permease; thus, flucytosine is metabolized to 5-fluorouracil within fungal organisms. The 5-fluorouracil is extensively incorporated into fungal RNA and inhibits synthesis of both DNA and RNA. The result is unbalanced growth and death of the fungal organism. It also appears to be an inhibitor of fungal thymidylate synthase. J - Antiinfectives for systemic use > J02 - Antimycotics for systemic use > J02A - Antimycotics for systemic use D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent D009676 - Noxae > D000963 - Antimetabolites Flucytosine (5-Fluorocytosine) is an antifungal compound with oral activity. Flucytosine is a widely used cytotoxic drug that, after further metabolism, produces fluorinated ribonucleotides and deoxyribonucleotides, inhibits DNA and protein synthesis, and has multiple effects such as inhibiting candida and candida neoplasm infection and producies cytotoxicity to cancer cells[1][2][3].

   

2-Acetyl-4,5-dihydrothiazole

1-(4,5-dihydro-1,3-thiazol-2-yl)ethan-1-one

C5H7NOS (129.0248)


2-Acetyl-4,5-dihydrothiazole is found in alcoholic beverages. 2-Acetyl-4,5-dihydrothiazole is reported in beef broth, roast beef and overpasteurized beer. Roasted meat-like flavour ingredient. Reported in beef broth, roast beef and overpasteurized beer. Roasted meat-like flavour ingredient. 2-Acetyl-4,5-dihydrothiazole is found in alcoholic beverages and animal foods.

   

5-Methoxy-2-methylthiazole

5-methoxy-2-methyl-1,3-thiazole

C5H7NOS (129.0248)


5-Methoxy-2-methylthiazole is a flavouring ingredient. Flavouring ingredient

   

2-Ethoxythiazole

Ethyl 2-thiazolyl ether

C5H7NOS (129.0248)


2-Ethoxythiazole is a flavouring ingredient. Flavouring ingredient

   

Epigoitrin

5-ethenyl-1,3-oxazolidine-2-thione

C5H7NOS (129.0248)


   

5-Ethoxythiazole

5-ethoxy-1,3-thiazole

C5H7NOS (129.0248)


5-ethoxythiazole is a member of the class of compounds known as alkyl aryl ethers. Alkyl aryl ethers are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R , where R is an alkyl group and R is an aryl group. 5-ethoxythiazole is slightly soluble (in water) and a moderately basic compound (based on its pKa). 5-ethoxythiazole can be found in guava, which makes 5-ethoxythiazole a potential biomarker for the consumption of this food product.

   

Goitrin

(5R)-5-ethenyl-1,3-oxazolidine-2-thione

C5H7NOS (129.0248)


5-ethenyl-1,3-oxazolidine-2-thione is a member of the class of oxazolidines that is 1,3-oxazolidine substituted by sulfanylidene and ethenyl groups at positions 2 and 5, respectively. It is a member of oxazolidines and an olefinic compound. DL-Goitrin is a natural product found in Isatis tinctoria with data available. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D013956 - Antithyroid Agents D000890 - Anti-Infective Agents > D023303 - Oxazolidinones (R)-goitrin is a 5-ethenyl-1,3-oxazolidine-2-thione that has R-configuration. It is a constituent of a traditional Chinese herbal medicine, Radix isatidis. It has a role as an antiviral agent and a plant metabolite. It is an enantiomer of a (S)-goitrin. Epigoitrin is a natural product found in Isatis tinctoria, Diplotaxis harra, and other organisms with data available. A 5-ethenyl-1,3-oxazolidine-2-thione that has R-configuration. It is a constituent of a traditional Chinese herbal medicine, Radix isatidis. DL-Goitrin, also called (R, S)- report by the spring, consists of the epigoitrin (reported by the R- Spring) and the spring (-S- reported by spring), and the two mutually isomers, and the mixture is the ingredient of cruciferous vegetables[1]. DL-Goitrin, also called (R, S)- report by the spring, consists of the epigoitrin (reported by the R- Spring) and the spring (-S- reported by spring), and the two mutually isomers, and the mixture is the ingredient of cruciferous vegetables[1]. Epigoitrin is a natural alkaloid from Isatis tinctoria, with antiviral activities. Epigoitrin reduces susceptibility to influenza virus via mitochondrial antiviral signaling[1][2]. Epigoitrin is a natural alkaloid from Isatis tinctoria, with antiviral activities. Epigoitrin reduces susceptibility to influenza virus via mitochondrial antiviral signaling[1][2].

   

Dinitrile-2,6-Pyridinedicarboxylic acid

Dinitrile-2,6-Pyridinedicarboxylic acid

C7H3N3 (129.0327)


   

1-Thiocyanato-2-hydroxy-3-butene

1-Thiocyanato-2-hydroxy-3-butene

C5H7NOS (129.0248)


   

beta-Hydroxythiiranepropanenitrile

beta-Hydroxythiiranepropanenitrile

C5H7NOS (129.0248)


   

5-Flurocytosine

5-Flurocytosine

C4H4FN3O (129.0338)


   

5-Fluorocytosine; AIF; CE0; CorrDec

5-Fluorocytosine; AIF; CE0; CorrDec

C4H4FN3O (129.0338)


   

5-Fluorocytosine; AIF; CE10; CorrDec

5-Fluorocytosine; AIF; CE10; CorrDec

C4H4FN3O (129.0338)


   

5-Fluorocytosine; AIF; CE30; CorrDec

5-Fluorocytosine; AIF; CE30; CorrDec

C4H4FN3O (129.0338)


   

5-Fluorocytosine; AIF; CE0; MS2Dec

5-Fluorocytosine; AIF; CE0; MS2Dec

C4H4FN3O (129.0338)


   

5-Fluorocytosine; AIF; CE10; MS2Dec

5-Fluorocytosine; AIF; CE10; MS2Dec

C4H4FN3O (129.0338)


   

5-Fluorocytosine; AIF; CE30; MS2Dec

5-Fluorocytosine; AIF; CE30; MS2Dec

C4H4FN3O (129.0338)


   

Acetylthiazoline

1-(4,5-dihydro-1,3-thiazol-2-yl)ethan-1-one

C5H7NOS (129.0248)


   

FEMA 3192

5-methoxy-2-methyl-1,3-thiazole

C5H7NOS (129.0248)


   

FEMA 3340

Ethyl 2-thiazolyl ether

C5H7NOS (129.0248)


   

5-METHYL-2-THIAZOLEMETHANOL

5-METHYL-2-THIAZOLEMETHANOL

C5H7NOS (129.0248)


   

2-Amino-5-fluoro-1H-pyrimidin-4-one

2-Amino-5-fluoro-1H-pyrimidin-4-one

C4H4FN3O (129.0338)


   

2-(1,3-Thiazol-2-yl)ethanol

2-(1,3-Thiazol-2-yl)ethanol

C5H7NOS (129.0248)


   

2,6-Pyridinedicarbonitrile

2,6-Pyridinedicarbonitrile

C7H3N3 (129.0327)


   

aniline,hydrochloride

aniline,hydrochloride

C6H8ClN (129.0345)


   

2-AMINO-4-HYDROXY-6-FLUOROPYRIMIDINE

2-AMINO-4-HYDROXY-6-FLUOROPYRIMIDINE

C4H4FN3O (129.0338)


   

2-chloroaniline-4,6-d2

2-chloroaniline-4,6-d2

C6H4ClD2N (129.0314)


   

4-Chloro(2,6-2H2)aniline

4-Chloro(2,6-2H2)aniline

C6H4ClD2N (129.0314)


   

3-Aminofurazan-4-carboxylic acid

3-Aminofurazan-4-carboxylic acid

C3H3N3O3 (129.0174)


   

1-(2-CHLOROETHYL)-1H-PYRROLE

1-(2-CHLOROETHYL)-1H-PYRROLE

C6H8ClN (129.0345)


   

5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxylic acid

5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxylic acid

C3H3N3O3 (129.0174)


   

3,3-Difluorazetidinhydrochlorid(1:1)

3,3-Difluorazetidinhydrochlorid(1:1)

C3H6ClF2N (129.0157)


   

2,2-Difluorocyclopropanamine hydrochloride

2,2-Difluorocyclopropanamine hydrochloride

C3H6ClF2N (129.0157)


   

(2-methylthiazol-4-yl)methanol

(2-methylthiazol-4-yl)methanol

C5H7NOS (129.0248)


   

DI(PROP-2-YN-1-YL)AMINE HYDROCHLORIDE

DI(PROP-2-YN-1-YL)AMINE HYDROCHLORIDE

C6H8ClN (129.0345)


   

2-CHLOROMETHYL-PIPERIDINE

2-CHLOROMETHYL-PIPERIDINE

C5H7NOS (129.0248)


   

PYRIDINE-2,4-DICARBONITRILE

PYRIDINE-2,4-DICARBONITRILE

C7H3N3 (129.0327)


   

Anilinium chloride

Anilinium chloride

C6H8ClN (129.0345)


   

1-Methylpyridinium chloride

1-Methylpyridinium chloride

C6H8ClN (129.0345)


   

2(3H)-Oxazolethione,4,5-dimethyl-

2(3H)-Oxazolethione,4,5-dimethyl-

C5H7NOS (129.0248)


   

(2-methyl-1,3-thiazol-5-yl)-methanol

(2-methyl-1,3-thiazol-5-yl)-methanol

C5H7NOS (129.0248)


   

3-(ACETYLTHIO)PROPIONITRILE

3-(ACETYLTHIO)PROPIONITRILE

C5H7NOS (129.0248)


   

2,3-Dicyanopyridine

2,3-Dicyanopyridine

C7H3N3 (129.0327)


   

2-BROMOPROPANE-D7

2-BROMOPROPANE-D7

C3BrD7 (129.017)


   

2-BROMO-4-ETHOXYMETHYL-PYRIDINE

2-BROMO-4-ETHOXYMETHYL-PYRIDINE

C6H8ClN (129.0345)


   

3,4-Pyridinedicarbonitrile

3,4-Pyridinedicarbonitrile

C7H3N3 (129.0327)


   

1H-1,2,4-Triazol-3-amine,5-nitro-

1H-1,2,4-Triazol-3-amine,5-nitro-

C2H3N5O2 (129.0287)


   

3-(ISOCYANATO)PROPYL-FUNCTIONALIZED SILICA GEL

3-(ISOCYANATO)PROPYL-FUNCTIONALIZED SILICA GEL

C4H7NO2Si (129.0246)


   

(4-Methyl-1,3-thiazol-2-yl)methanol

(4-Methyl-1,3-thiazol-2-yl)methanol

C5H7NOS (129.0248)


   

Cyanuric Acid-13C3

Cyanuric Acid-13C3

C3H3N3O3 (129.0174)


   

2,5-DICYANOPYRIDINE

2,5-DICYANOPYRIDINE

C7H3N3 (129.0327)


   

2(1H)-Pyrimidinone,4-amino-6-fluoro-

2(1H)-Pyrimidinone,4-amino-6-fluoro-

C4H4FN3O (129.0338)


   

3,5-pyridinedicarbonitrile

3,5-pyridinedicarbonitrile

C7H3N3 (129.0327)


   

(5-METHOXY-1H-INDOL-3-YL)-ACETICACIDHYDRAZIDE

(5-METHOXY-1H-INDOL-3-YL)-ACETICACIDHYDRAZIDE

C5H7NOS (129.0248)


   

5-(2-Hydroxyethyl)-1,3-thiazole

5-(2-Hydroxyethyl)-1,3-thiazole

C5H7NOS (129.0248)


   
   

Acetylpyruvate

Acetylpyruvate

C5H5O4- (129.0188)


   

2,5-Dioxopentanoate

2,5-Dioxopentanoate

C5H5O4- (129.0188)


   

Ureidoacrylate

Ureidoacrylate

C4H5N2O3- (129.03)


   

4,5-Dioxopentanoate

4,5-Dioxopentanoate

C5H5O4- (129.0188)


   

(S)-alpha-hydroxyglutarate-gamma-lactone

(S)-alpha-hydroxyglutarate-gamma-lactone

C5H5O4- (129.0188)


   

Penam

Penam

C5H7NOS (129.0248)


Compound comprising a beta-lactam ring fused to a saturated 5-membered ring containing one sulfur atom. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002969 - Clavulanic Acids D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

(3R)-3-hydroxy-4,5-epithiopentyl nitrile

(3R)-3-hydroxy-4,5-epithiopentyl nitrile

C5H7NOS (129.0248)


   

[(S)-2-Hydroxy-3-butenyl] isothiocyanate

[(S)-2-Hydroxy-3-butenyl] isothiocyanate

C5H7NOS (129.0248)


   

CYANURIC ACID

Tricyanic acid

C3H3N3O3 (129.0174)


   

2-Acetyl-2-thiazoline

2-Acetyl-2-thiazoline

C5H7NOS (129.0248)


   

5-Methoxy-2-methylthiazole

5-Methoxy-2-methylthiazole

C5H7NOS (129.0248)


   

(S)-goitrin

(S)-goitrin

C5H7NOS (129.0248)


A 5-ethenyl-1,3-oxazolidine-2-thione that has S-configuration. It is a constituent of a traditional Chinese herbal medicine, Radix isatidis.

   

1-thiocyanato-2-hydroxy-3-butene

NA

C5H7NOS (129.0248)


{"Ingredient_id": "HBIN003345","Ingredient_name": "1-thiocyanato-2-hydroxy-3-butene","Alias": "NA","Ingredient_formula": "C5H7NOS","Ingredient_Smile": "C=CC(CSC#N)O","Ingredient_weight": "129.18","OB_score": "57.7776668","CAS_id": "79157-67-8","SymMap_id": "SMIT00477","TCMID_id": "21318","TCMSP_id": "MOL001784","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

1-thiocyano-2-hydroxy-3-butene

NA

C5H7NOS (129.0248)


{"Ingredient_id": "HBIN003346","Ingredient_name": "1-thiocyano-2-hydroxy-3-butene","Alias": "NA","Ingredient_formula": "C5H7NOS","Ingredient_Smile": "C=CC(CSC#N)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32061","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(5r)-5-ethenyl-4,5-dihydro-1,3-oxazole-2-thiol

(5r)-5-ethenyl-4,5-dihydro-1,3-oxazole-2-thiol

C5H7NOS (129.0248)


   

(5s)-5-ethenyl-4,5-dihydro-1,3-oxazole-2-thiol

(5s)-5-ethenyl-4,5-dihydro-1,3-oxazole-2-thiol

C5H7NOS (129.0248)