Exact Mass: 172.0767

Exact Mass Matches: 172.0767

Found 234 metabolites which its exact mass value is equals to given mass value 172.0767, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Glycylproline

(2S)-1-(2-aminoacetyl)pyrrolidine-2-carboxylic acid

C7H12N2O3 (172.0848)


Glycylproline is an end product of collagen metabolism that is further cleaved by prolidase (EC 3.4.13.9); the resulting proline molecules are recycled into collagen or other proteins. Prolidase deficiency is a rare autosomal recessive disease characterized by chronic ulcerative dermatitis, mental retardation, frequent infections and massive urinary excretion of iminodipeptides. The disease has been confirmed to be due to hereditary prolidase deficiency. It has been reported that the activity of the enzyme against glycylproline (Gly-Pro) is almost totally deficient in patients with prolidase deficiency, whereas the activity against other substrates is not so deficient. Some patients with prolidase deficiency have a marked urinary excretion of the iminodipeptide Glycylproline. The urine from patients with pressure sores contains significantly more Glycylproline than the urine from the control. (PMID: 16009141, 7629169, 1536787, 10582130) [HMDB] Glycylproline is a dipeptide composed of glycine and proline, and is an end product of collagen metabolism that is further cleaved by prolidase (EC 3.4.13.9). The resulting proline molecules are recycled into collagen or other proteins. Prolidase deficiency is a rare autosomal recessive disease characterized by chronic ulcerative dermatitis, mental retardation, frequent infections, and massive urinary excretion of iminodipeptides. Patients with this disease have reportedly decreased prolidase enzyme activity against glycylproline (Gly-Pro). The enzymes activity against other substrates is not as affected. Some patients with prolidase deficiency have a marked urinary excretion of glycylproline. Patients with pressure sores contain significantly more urinary glycylproline than the control (PMID: 16009141, 7629169, 1536787, 10582130). H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase.

   

Prolylglycine

2-{[(2S)-pyrrolidin-2-yl]formamido}acetic acid

C7H12N2O3 (172.0848)


Prolylglycine is a dipeptide composed of proline and glycine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. It is found in urine (PMID: 3782411). L-Prolylglycine is an endogenous metabolite.

   

Diethyl fumarate

2-Butenedioic acid (e)-, diethyl ester (9ci)

C8H12O4 (172.0736)


Diethyl fumarate is a fungal growth inhibitor for tomato juice. Flavouring compound [Superscent] Diethyl fumarate is a decomposition product of Malathion (an insecticide). Diethyl fumarate is a reputed skin irritant. Diethyl fumarate can causes non-immunologic contact urticaria on skin[1][2].

   

2-Octenedioic acid

1-Hexene-1,6-dicarboxylic acid

C8H12O4 (172.0736)


2-Octenedioic acid is an unsaturated dicarboxylic acid found in the urine of persons with abnormal fatty acid metabolism, such as patients with Dicarboxylic aciduria (PMID 2094705, 2614263). [HMDB] 2-Octenedioic acid is an unsaturated dicarboxylic acid found in the urine of persons with abnormal fatty acid metabolism, such as patients with Dicarboxylic aciduria (PMID 2094705, 2614263).

   

cis-4-Octenedioic acid

cis-4-Octene-1,8-dioic acid

C8H12O4 (172.0736)


cis-4-Octenedioic acid, also known as (Z)-4-octene-1,8-dioate, belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups. cis-4-Octenedioic acid is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. 4-Octenedioic acid have been found slightly elevated in the urine of persons with abnormal fatty acid metabolism (PMID 2094705) [HMDB]

   

trans-3-Octenedioic acid

trans-3-Octene -1,8-dioic acid

C8H12O4 (172.0736)


trans-3-Octenedioic acid is a mono-unsaturated dicarboxylic acid and isomer of octenedioic acids. Octenedioic acids can be derived from the oxidation of oleic and linoleic acids and are a urinary metabolites occurring in patients with dicarboxylic aciduria.(PMID: 2271537) [HMDB] trans-3-Octenedioic acid is a mono-unsaturated dicarboxylic acid and isomer of octenedioic acids. Octenedioic acids can be derived from the oxidation of oleic and linoleic acids and are a urinary metabolites occurring in patients with dicarboxylic aciduria.(PMID: 2271537).

   

3-Isopropenylpentanedioic acid

3-(prop-1-en-2-yl)pentanedioic acid

C8H12O4 (172.0736)


3-Isopropenylpentanedioic acid is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

   

Ethyl 2,4-dioxohexanoate

Hexanoic acid, 2,4-dioxo-, ethyl ester

C8H12O4 (172.0736)


Ethyl 2,4-dioxohexanoate is a flavouring ingredien Flavouring ingredient

   

1,2-Cyclohexanedicarboxylic acid

cyclohexane-1,2-dicarboxylic acid

C8H12O4 (172.0736)


   

2-Butenedioic acid (2E)-, 1,4-diethyl ester

2-Butenedioic acid (2E)-, 1,4-diethyl ester

C8H12O4 (172.0736)


   

Glycyl-D-proline

1-(2-aminoacetyl)pyrrolidine-2-carboxylic acid

C7H12N2O3 (172.0848)


   

2,3-Diethylbut-2-enedioic acid

2,3-Diethylbut-2-enedioic acid

C8H12O4 (172.0736)


   

7YYD00RL0S

Chuanxiongzine hydrochloride;Tetramethylpyrazine hydrochloride

C8H13ClN2 (172.0767)


   

ligustrazine

Chuanxiongzine hydrochloride;Tetramethylpyrazine hydrochloride

C8H12N2.HCl (172.0767)


   

Musacin F

Musacin F

C8H12O4 (172.0736)


   

Cleroindicin D

Cleroindicin D

C8H12O4 (172.0736)


   

5-hydroxy-4-(hydroxymethyl)hexahydro-2H-cyclopenta[b]furan-2-one

5-hydroxy-4-(hydroxymethyl)hexahydro-2H-cyclopenta[b]furan-2-one

C8H12O4 (172.0736)


   

5-(2-phenylethenyl)-2H-tetrazole

5-(2-phenylethenyl)-2H-tetrazole

C9H8N4 (172.0749)


   

cis-Hexahydroterephthalic acid

Trans-1,4-Cyclohexanedicarboxylic Acid

C8H12O4 (172.0736)


   

5,6-Dihydropenicillic acid

5,6-Dihydropenicillic acid

C8H12O4 (172.0736)


   

2,4,8-trihydroxybicyclo[3.2.1]octan-3-one

2,4,8-trihydroxybicyclo[3.2.1]octan-3-one

C8H12O4 (172.0736)


   

2,4-dimethoxy-2-methyl-6h-pyran-3-one

2,4-dimethoxy-2-methyl-6h-pyran-3-one

C8H12O4 (172.0736)


   

4,8-dimethyl-1,5-dioxocane-2,6-dione

4,8-dimethyl-1,5-dioxocane-2,6-dione

C8H12O4 (172.0736)


   

(1S,2R,5S,6R)-5,6-dihydroxy-2-methylcyclohex-3-enecarboxylic acid|massarigenin E

(1S,2R,5S,6R)-5,6-dihydroxy-2-methylcyclohex-3-enecarboxylic acid|massarigenin E

C8H12O4 (172.0736)


   

rel-(4R,5S)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-enone

rel-(4R,5S)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-enone

C8H12O4 (172.0736)


   

myrolactone A

myrolactone A

C8H12O4 (172.0736)


   

5-acetyloxy-3-methylpent-2-enoic acid

5-acetyloxy-3-methylpent-2-enoic acid

C8H12O4 (172.0736)


   

2-(1-hydroxy-4-oxocyclohexyl)acetic acid

2-(1-hydroxy-4-oxocyclohexyl)acetic acid

C8H12O4 (172.0736)


   

2-{4-hydroxy-7-oxabicyclo[2.2.1]heptanyl}acetic acid

2-{4-hydroxy-7-oxabicyclo[2.2.1]heptanyl}acetic acid

C8H12O4 (172.0736)


   

4,6-dihydroxy-6-(2-hydroxyethyl)cyclohex-2-en-1-one

4,6-dihydroxy-6-(2-hydroxyethyl)cyclohex-2-en-1-one

C8H12O4 (172.0736)


   

1,2,3-propanetriol, 1-(5-methyl-3-furanyl)-

1,2,3-propanetriol, 1-(5-methyl-3-furanyl)-

C8H12O4 (172.0736)


   

SCHEMBL8019772

SCHEMBL8019772

C8H12O4 (172.0736)


   

Methyl 4,6-dioxoheptanoate

Methyl 4,6-dioxoheptanoate

C8H12O4 (172.0736)


   

2-(1-Methylethylidene)pentanedioic acid

2-(1-Methylethylidene)pentanedioic acid

C8H12O4 (172.0736)


   

H-Gly-Pro-OH

Glycyl-L-proline

C7H12N2O3 (172.0848)


Acquisition and generation of the data is financially supported in part by CREST/JST. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase.

   

3-[(E)-prop-1-enyl]pentanedioic acid

NCGC00381342-01!3-[(E)-prop-1-enyl]pentanedioic acid

C8H12O4 (172.0736)


   

2-Octenedioic acid

2-Octenedioic acid

C8H12O4 (172.0736)


   

Glycylproline

Glycylproline

C7H12N2O3 (172.0848)


H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase.

   

cis-4-octenedioic acid

cis-4-octenedioic acid

C8H12O4 (172.0736)


   

1,4-CYCLOHEXANEDICARBOXYLIC ACID

1,4-CYCLOHEXANEDICARBOXYLIC ACID

C8H12O4 (172.0736)


   

Glycyl-Proline; AIF; CE0; CorrDec

Glycyl-Proline; AIF; CE0; CorrDec

C7H12N2O3 (172.0848)


   

Glycyl-Proline; AIF; CE10; CorrDec

Glycyl-Proline; AIF; CE10; CorrDec

C7H12N2O3 (172.0848)


   

Glycyl-Proline; AIF; CE30; CorrDec

Glycyl-Proline; AIF; CE30; CorrDec

C7H12N2O3 (172.0848)


   

Glycyl-Proline; AIF; CE0; MS2Dec

Glycyl-Proline; AIF; CE0; MS2Dec

C7H12N2O3 (172.0848)


   

Glycyl-Proline; AIF; CE10; MS2Dec

Glycyl-Proline; AIF; CE10; MS2Dec

C7H12N2O3 (172.0848)


   

Glycyl-Proline; AIF; CE30; MS2Dec

Glycyl-Proline; AIF; CE30; MS2Dec

C7H12N2O3 (172.0848)


   

Glycyl-proline; LC-tDDA; CE10

Glycyl-proline; LC-tDDA; CE10

C7H12N2O3 (172.0848)


   

Glycyl-proline; LC-tDDA; CE20

Glycyl-proline; LC-tDDA; CE20

C7H12N2O3 (172.0848)


   

Glycyl-proline; LC-tDDA; CE30

Glycyl-proline; LC-tDDA; CE30

C7H12N2O3 (172.0848)


   

Glycyl-proline; LC-tDDA; CE40

Glycyl-proline; LC-tDDA; CE40

C7H12N2O3 (172.0848)


   

Garlicin_major

Garlicin_major

C8H12O4 (172.0736)


   

5,6-dihydropenicillic acid_major

5,6-dihydropenicillic acid_major

C8H12O4 (172.0736)


   
   
   

5-δ-Hydroxybutyl Hydantoin

5-(4-Hydroxybutyl)imidazolidine-2,4-dione

C7H12N2O3 (172.0848)


   

4Z-octenedioic acid

cis-4-octenedioic acid

C8H12O4 (172.0736)


   

2-Octenedioate

1-Hexene-1,6-dicarboxylic acid

C8H12O4 (172.0736)


   

4-Octenedioic acid

4-Octenedioic acid

C8H12O4 (172.0736)


   

Pro-Gly

L-prolyl-L-glycine

C7H12N2O3 (172.0848)


A dipeptide formed from L-proline and glycine residues. L-Prolylglycine is an endogenous metabolite.

   

(-)-Corey lactone diol

(3aR,4S,5R,6aS)-hexahydro-5-hydroxy-4-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one

C8H12O4 (172.0736)


   

4,7-dioxo-octanoic acid

4,7-dioxo-octanoic acid

C8H12O4 (172.0736)


   

3-Isopropenylpentanedioic acid

3-(prop-1-en-2-yl)pentanedioic acid

C8H12O4 (172.0736)


   

FEMA 3278

Hexanoic acid, 2,4-dioxo-, ethyl ester

C8H12O4 (172.0736)


   

Ethyl maleate

2-Butenedioic acid (e)-, diethyl ester (9ci)

C8H12O4 (172.0736)


Diethyl fumarate is a decomposition product of Malathion (an insecticide). Diethyl fumarate is a reputed skin irritant. Diethyl fumarate can causes non-immunologic contact urticaria on skin[1][2].

   

FA 8:2;O2

4,7-dioxo-octanoic acid

C8H12O4 (172.0736)


   

Oct-4-enedioic acid

Oct-4-enedioic acid

C8H12O4 (172.0736)


   

cis-3-carbomethoxycyclopentane-1-carboxylic acid

cis-3-carbomethoxycyclopentane-1-carboxylic acid

C8H12O4 (172.0736)


   

3-(2,5-Difluorophenyl)-1-propanol

3-(2,5-Difluorophenyl)-1-propanol

C9H10F2O (172.07)


   

sodium,2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate

sodium,2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate

C6H9D4NaO2Si (172.0834)


   

2-Butenoic acid,3-[(aminocarbonyl)amino]-, ethyl ester

2-Butenoic acid,3-[(aminocarbonyl)amino]-, ethyl ester

C7H12N2O3 (172.0848)


   

CIS-2-(METHOXYCARBONYL)CYCLOPENTANECARBOXYLIC ACID

CIS-2-(METHOXYCARBONYL)CYCLOPENTANECARBOXYLIC ACID

C8H12O4 (172.0736)


   

1,4-diacetoxy-2-butene

1,4-diacetoxy-2-butene

C8H12O4 (172.0736)


   

1-Piperazinecarboxylicacid,3-oxo-,ethylester(9CI)

1-Piperazinecarboxylicacid,3-oxo-,ethylester(9CI)

C7H12N2O3 (172.0848)


   

(4Z)-4-(ETHOXYMETHYLENE)ISOQUINOLINE-1,3(2H,4H)-DIONE

(4Z)-4-(ETHOXYMETHYLENE)ISOQUINOLINE-1,3(2H,4H)-DIONE

C8H12O4 (172.0736)


   

1,2-DIFLUORO-4-ISOPROPOXYBENZENE

1,2-DIFLUORO-4-ISOPROPOXYBENZENE

C9H10F2O (172.07)


   

3,4-Dimethylphenylhydrazine hydrochloride

3,4-Dimethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767)


   

Dimethyl isopropylidenemalonate

Dimethyl isopropylidenemalonate

C8H12O4 (172.0736)


   

Methyl 3-acetyl-4-oxopentanoate

Methyl 3-acetyl-4-oxopentanoate

C8H12O4 (172.0736)


   

Lura

(1R,2R)-(-)-1,2-Cyclohexanedicarboxylic Acid

C8H12O4 (172.0736)


   

1,3-Cyclohexanedicarboxylic acid

1,3-Cyclohexanedicarboxylic acid

C8H12O4 (172.0736)


   

n-Butyl fumarate

n-Butyl fumarate

C8H12O4 (172.0736)


   

Dimethyl trans-3-Hexenedioate

3-Hexenedioic acid,1,6-dimethyl ester, (3E)-

C8H12O4 (172.0736)


   

Diethyl methylenemalonate

Diethyl methylenemalonate

C8H12O4 (172.0736)


   

2-(1-methyl-3-oxo-2-piperazinyl)acetic acid

2-(1-methyl-3-oxo-2-piperazinyl)acetic acid

C7H12N2O3 (172.0848)


   

2,3-DIOXO-BUTYRIC ACID TERT-BUTYL ESTER

2,3-DIOXO-BUTYRIC ACID TERT-BUTYL ESTER

C8H12O4 (172.0736)


   

Urea,1-acetyl-3-butyryl- (4CI)

Urea,1-acetyl-3-butyryl- (4CI)

C7H12N2O3 (172.0848)


   

POLY(VINYL ACETATE-CO-CROTONIC ACID)

POLY(VINYL ACETATE-CO-CROTONIC ACID)

C8H12O4 (172.0736)


   

1-(3,5-difluorophenyl)propan-1-ol

1-(3,5-difluorophenyl)propan-1-ol

C9H10F2O (172.07)


   

Dimethyl 2-methylenepentanedioate

Dimethyl 2-methylenepentanedioate

C8H12O4 (172.0736)


   

Dimethyl 3-methylpent-2-enedioate

Dimethyl 3-methylpent-2-enedioate

C8H12O4 (172.0736)


   

Dimethyl 2-allylmalonate

Dimethyl 2-allylmalonate

C8H12O4 (172.0736)


   

Betahistine Hydrochloride

Betahistine Hydrochloride

C8H13ClN2 (172.0767)


   

(1R,3S)-3-(Methoxycarbonyl)cyclopentanecarboxylic acid

(1R,3S)-3-(Methoxycarbonyl)cyclopentanecarboxylic acid

C8H12O4 (172.0736)


   

2-Ethoxy-4-fluoro-6-hydrazinopyrimidine

2-Ethoxy-4-fluoro-6-hydrazinopyrimidine

C6H9FN4O (172.076)


   

2-pent-4-enylpropanedioic acid

2-pent-4-enylpropanedioic acid

C8H12O4 (172.0736)


   

BUT-3-ENE-1,2-DIYL DIACETATE

BUT-3-ENE-1,2-DIYL DIACETATE

C8H12O4 (172.0736)


   

2-(dimethylaminomethyl)-4-thiazolemethanol

2-(dimethylaminomethyl)-4-thiazolemethanol

C7H12N2OS (172.067)


   

2,3-dimethylphenylhydrazine hydrochloride

2,3-dimethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767)


   

(1S,2S)-1,2-cyclohexanedicarboxylicacid

(1S,2S)-1,2-cyclohexanedicarboxylicacid

C8H12O4 (172.0736)


   

3-(3,4-Difluorophenyl)-1-propanol

3-(3,4-Difluorophenyl)-1-propanol

C9H10F2O (172.07)


   

POLY(ETHYL ACRYLATE/ACRYLIC ACID)

POLY(ETHYL ACRYLATE/ACRYLIC ACID)

C8H12O4 (172.0736)


   

5-CHLOROMETHYL-1-ISOBUTYL-1H-IMIDAZOLE

5-CHLOROMETHYL-1-ISOBUTYL-1H-IMIDAZOLE

C8H13ClN2 (172.0767)


   

n,n-dimethyl-p-phenylenediamine monohydrochloride

n,n-dimethyl-p-phenylenediamine monohydrochloride

C8H13ClN2 (172.0767)


   

(2,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

(2,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

C8H13ClN2 (172.0767)


   

(R)-4-(3-ISOPROPOXYPHENYL)-1,3-DIMETHYL-1,2,3,6-TETRAHYDRO-PYRIDINE

(R)-4-(3-ISOPROPOXYPHENYL)-1,3-DIMETHYL-1,2,3,6-TETRAHYDRO-PYRIDINE

C8H12O4 (172.0736)


   

DIMETHYL 1,1-CYCLOBUTANEDICARBOXYLATE

DIMETHYL 1,1-CYCLOBUTANEDICARBOXYLATE

C8H12O4 (172.0736)


   

Octanoic acid,5,7-dioxo-

Octanoic acid,5,7-dioxo-

C8H12O4 (172.0736)


   

cis-1,2-Cyclohexanedicarboxylic acid

cis-Cyclohexane-1,2-dicarboxylic acid

C8H12O4 (172.0736)


   

methyl 2-[(2S)-3-oxo-2,4,5,6-tetrahydropyrazin-2-yl]acetate

methyl 2-[(2S)-3-oxo-2,4,5,6-tetrahydropyrazin-2-yl]acetate

C7H12N2O3 (172.0848)


   

1,2-Difluoro-3-isopropoxybenzene

1,2-Difluoro-3-isopropoxybenzene

C9H10F2O (172.07)


   

trans-(±)-1,3-Cyclohexanedicarboxylic acid

trans-(±)-1,3-Cyclohexanedicarboxylic acid

C8H12O4 (172.0736)


   

(2,5-dimethylphenyl)hydrazine hydrochloride

(2,5-dimethylphenyl)hydrazine hydrochloride

C8H13ClN2 (172.0767)


   

5-ethenyl-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid

5-ethenyl-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid

C8H12O4 (172.0736)


   

2-Fluorobiphenyl

2-Fluorobiphenyl

C12H9F (172.0688)


   

1-Naphthaleneboronic acid

1-Naphthaleneboronic acid

C10H9BO2 (172.0696)


   

3-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

3-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

C8H13ClN2 (172.0767)


   

2-Ethylphenylhydrazine hydrochloride

2-Ethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767)


   

4-pyridin-3-ylpyrimidin-2-amine

4-pyridin-3-ylpyrimidin-2-amine

C9H8N4 (172.0749)


   

(2Z)-2-Butene-1,4-diyl diacetate

(2Z)-2-Butene-1,4-diyl diacetate

C8H12O4 (172.0736)


   

3-FLUORO-1,1-BIPHENYL

3-FLUORO-1,1-BIPHENYL

C12H9F (172.0688)


   

Ethyl 4-oxotetrahydro-2H-pyran-3-carboxylate

Ethyl 4-oxotetrahydro-2H-pyran-3-carboxylate

C8H12O4 (172.0736)


   

Ethyl 5-hydroxy-3,6-dihydro-2H-pyran-4-carboxylate

Ethyl 5-hydroxy-3,6-dihydro-2H-pyran-4-carboxylate

C8H12O4 (172.0736)


   

(4-METHYL-2-PHENYL-1,3-THIAZOL-5-YL)METHANAMINE

(4-METHYL-2-PHENYL-1,3-THIAZOL-5-YL)METHANAMINE

C8H13ClN2 (172.0767)


   

ethyl 2-acetylacetoacetate

ethyl 2-acetylacetoacetate

C8H12O4 (172.0736)


   

2-Propene-1,1-diol,2-methyl-, 1,1-diacetate

2-Propene-1,1-diol,2-methyl-, 1,1-diacetate

C8H12O4 (172.0736)


   

Monobutyl maleate

Monobutyl maleate

C8H12O4 (172.0736)


   

2-methyl-N-(1,3,4-thiadiazol-2-yl)propane-1,2-diamine

2-methyl-N-(1,3,4-thiadiazol-2-yl)propane-1,2-diamine

C6H12N4S (172.0783)


   

1-(Ethoxycarbonyl)cyclobutanecarboxylic acid

1-(Ethoxycarbonyl)cyclobutanecarboxylic acid

C8H12O4 (172.0736)


   

1-carbamoylpiperidine-4-carboxylic acid

1-carbamoylpiperidine-4-carboxylic acid

C7H12N2O3 (172.0848)


   

1-(aminocarbonyl)piperidine-3-carboxylic acid(SALTDATA: HCl)

1-(aminocarbonyl)piperidine-3-carboxylic acid(SALTDATA: HCl)

C7H12N2O3 (172.0848)


   

2-(Furfurylthio)ethylamine

2-(Furfurylthio)ethylamine

C7H12N2O3 (172.0848)


   

ETHYL 4-ETHOXY-2-OXOBUT-3-ENOATE

ETHYL 4-ETHOXY-2-OXOBUT-3-ENOATE

C8H12O4 (172.0736)


   

ETHYL 2-ACETYL-3-HYDROXY-2-BUTENOATE

ETHYL 2-ACETYL-3-HYDROXY-2-BUTENOATE

C8H12O4 (172.0736)


   

3S-(3a,3a,6a)]-Hexahydrofuro[2,3-b]furan-3-ol Acetate

3S-(3a,3a,6a)]-Hexahydrofuro[2,3-b]furan-3-ol Acetate

C8H12O4 (172.0736)


   

4-amino-3-tert-butyl-1H-1,2,4-triazole-5-thione

4-amino-3-tert-butyl-1H-1,2,4-triazole-5-thione

C6H12N4S (172.0783)


   

5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

C9H8N4 (172.0749)


   

1-Carbamoyl-piperidine-4-carboxylic acid

1-Carbamoyl-piperidine-4-carboxylic acid

C7H12N2O3 (172.0848)


   

(1S,2S)-TRANS-1,2-CYCLOHEXANEDIOL

(1S,2S)-TRANS-1,2-CYCLOHEXANEDIOL

C8H12O4 (172.0736)


   

METHYL 3-ACETOXY-2-METHYLENEBUTYRATE

METHYL 3-ACETOXY-2-METHYLENEBUTYRATE

C8H12O4 (172.0736)


   

1H-Benzimidazole-5-carbonitrile,2-amino-1-methyl-(9CI)

1H-Benzimidazole-5-carbonitrile,2-amino-1-methyl-(9CI)

C9H8N4 (172.0749)


   

Cyclopentanemalonic acid

Cyclopentanemalonic acid

C8H12O4 (172.0736)


   

METHYL 3-METHOXY-2-OXO-1-CYCLOPENTANECARBOXYLATE

METHYL 3-METHOXY-2-OXO-1-CYCLOPENTANECARBOXYLATE

C8H12O4 (172.0736)


   

(3,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

(3,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

C8H13ClN2 (172.0767)


   

4-(2-Aminoethyl)aniline hydrochloride (1:1)

4-(2-Aminoethyl)aniline hydrochloride (1:1)

C8H13ClN2 (172.0767)


   

Dimethyl 1,2-cyclobutanedicarboxylate

Dimethyl 1,2-cyclobutanedicarboxylate

C8H12O4 (172.0736)


   

cis-1,2-cyclobutanedicarboxylic acid dimethyl ester

cis-1,2-cyclobutanedicarboxylic acid dimethyl ester

C8H12O4 (172.0736)


   

(+)-Corey lactone

(+)-Corey lactone

C8H12O4 (172.0736)


   

2,4-Difluoro-1-isopropoxybenzene

2,4-Difluoro-1-isopropoxybenzene

C9H10F2O (172.07)


   

5-BROMO-3-HYDROXY-3-(2-OXOPROPYL)-1,3-DIHYDRO-2H-INDOL-2-ONE

5-BROMO-3-HYDROXY-3-(2-OXOPROPYL)-1,3-DIHYDRO-2H-INDOL-2-ONE

C8H13ClN2 (172.0767)


   

cyclohexane-1,1-dicarboxylic acid

cyclohexane-1,1-dicarboxylic acid

C8H12O4 (172.0736)


   

2-Ethylphenyl hydrazine HCl

2-Ethylphenyl hydrazine HCl

C8H13ClN2 (172.0767)


   

4-pyridin-4-ylpyrimidin-2-amine

4-pyridin-4-ylpyrimidin-2-amine

C9H8N4 (172.0749)


   

2-(4-morpholino)ethyl isothiocyanate

2-(4-morpholino)ethyl isothiocyanate

C7H12N2OS (172.067)


   

cis-1,3-cyclohexanedicarboxylic acid

cis-1,3-cyclohexanedicarboxylic acid

C8H12O4 (172.0736)


   

1,2-Difluoro-3-propoxybenzene

1,2-Difluoro-3-propoxybenzene

C9H10F2O (172.07)


   

(3-ETHYL-PHENYL)-HYDRAZINE HYDROCHLORIDE

(3-ETHYL-PHENYL)-HYDRAZINE HYDROCHLORIDE

C8H13ClN2 (172.0767)


   

2-pyridin-3-ylpyrimidin-4-amine

2-pyridin-3-ylpyrimidin-4-amine

C9H8N4 (172.0749)


   

trans-cyclobutane-dicarboxylic acid-(1.3)-dimethyl ester

trans-cyclobutane-dicarboxylic acid-(1.3)-dimethyl ester

C8H12O4 (172.0736)


   

3-deoxy-1,2-O-isopropylidene-α-D-erythro-pentodialdo-1,4-furanose aldehyde

3-deoxy-1,2-O-isopropylidene-α-D-erythro-pentodialdo-1,4-furanose aldehyde

C8H12O4 (172.0736)


   

4,5-dimethyl-o-phenylenediamine, dihydrochloride

4,5-dimethyl-o-phenylenediamine, dihydrochloride

C8H13ClN2 (172.0767)


   

3-tert-butyl-2-thiohydantoin

3-tert-butyl-2-thiohydantoin

C7H12N2OS (172.067)


   

trans-1,3-cyclohexanedicarboxylic acid

trans-1,3-cyclohexanedicarboxylic acid

C8H12O4 (172.0736)


   

2,6-difluoro-4-propylphenol

2,6-difluoro-4-propylphenol

C9H10F2O (172.07)


   

2-(4-Pyridinyl)-4-pyrimidinamine

2-(4-Pyridinyl)-4-pyrimidinamine

C9H8N4 (172.0749)


   

2-Naphthaleneboronic acid

2-Naphthaleneboronic acid

C10H9BO2 (172.0696)


   

BUT-2-ENE-1,4-DIYL DIACETATE

BUT-2-ENE-1,4-DIYL DIACETATE

C8H12O4 (172.0736)


   

4-(2-Pyridinyl)-2-pyrimidinamine

4-(2-Pyridinyl)-2-pyrimidinamine

C9H8N4 (172.0749)


   

4-Fluorobiphenyl

4-Fluorobiphenyl

C12H9F (172.0688)


   

(4-Ethylphenyl)hydrazine hydrochloride (1:1)

(4-Ethylphenyl)hydrazine hydrochloride (1:1)

C8H13ClN2 (172.0767)


   

Ethyl 4-oxotetrahydro-2H-pyran-2-carboxylate

Ethyl 4-oxotetrahydro-2H-pyran-2-carboxylate

C8H12O4 (172.0736)


   

dimethyl 3-methyl-trans-1,2-cyclopropanedicarboxylate

dimethyl 3-methyl-trans-1,2-cyclopropanedicarboxylate

C8H12O4 (172.0736)


   

5-[2-(dimethylamino)ethyl]-1,3,4-thiadiazol-2-amine

5-[2-(dimethylamino)ethyl]-1,3,4-thiadiazol-2-amine

C6H12N4S (172.0783)


   

3,5-Dimethylphenylhydrazine hydrochloride

3,5-Dimethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767)


   

4-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

4-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

C8H13ClN2 (172.0767)


   

ethyl 3-oxotetrahydro-2H-pyran-4-carboxylate

ethyl 3-oxotetrahydro-2H-pyran-4-carboxylate

C8H12O4 (172.0736)


   
   

Diethyl fumarate

Diethyl fumarate

C8H12O4 (172.0736)


A dieter obtained by the formal condensation of fumaric acid with ethanol. Diethyl fumarate is a decomposition product of Malathion (an insecticide). Diethyl fumarate is a reputed skin irritant. Diethyl fumarate can causes non-immunologic contact urticaria on skin[1][2].

   

4,7-Dioxooctanoic acid

4,7-Dioxooctanoic acid

C8H12O4 (172.0736)


A dioxo monocarboxylic acid that is caprylic acid with the two oxo groups at the 4- and 7-positions.

   

Valanimycin

Valanimycin

C7H12N2O3 (172.0848)


An azoxy compound that is acrylic acid in which the olefinic hydrogen at position 2 has been replaced by an isobutyl-ONN-azoxy group.

   

9H-Fluoren-9-yllithium

9H-Fluoren-9-yllithium

C13H9Li (172.0864)


   

2-Formyloxan-3-yl acetate

2-Formyloxan-3-yl acetate

C8H12O4 (172.0736)


   

4,7-dihydroxyhexahydro-2-benzofuran-1(3H)-one

4,7-dihydroxyhexahydro-2-benzofuran-1(3H)-one

C8H12O4 (172.0736)


D009676 - Noxae > D000988 - Antispermatogenic Agents > D013089 - Spermatocidal Agents D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D020011 - Protective Agents > D016588 - Anticarcinogenic Agents D020011 - Protective Agents > D016587 - Antimutagenic Agents D000970 - Antineoplastic Agents

   

5-Hydroxy-4-methoxy-5-(1-methylethyl)-2(5H)-furanone

5-Hydroxy-4-methoxy-5-(1-methylethyl)-2(5H)-furanone

C8H12O4 (172.0736)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   
   

L-prolinylglycine zwitterion

L-prolinylglycine zwitterion

C7H12N2O3 (172.0848)


   

6-Diazo-5-oxonorleucine

6-Diazo-5-oxonorleucine

C6H10N3O3+ (172.0722)


   

(5-Amino-5-carboxy-2-oxopentylidene)-iminoazanium

(5-Amino-5-carboxy-2-oxopentylidene)-iminoazanium

C6H10N3O3+ (172.0722)


   

Diethylfumaric acid

Diethylfumaric acid

C8H12O4 (172.0736)


   

3-(2-methylpropylthio)-1H-1,2,4-triazol-5-amine

3-(2-methylpropylthio)-1H-1,2,4-triazol-5-amine

C6H12N4S (172.0783)


   

3-[(E)-prop-1-enyl]pentanedioic acid

3-[(E)-prop-1-enyl]pentanedioic acid

C8H12O4 (172.0736)


   

(5S)-5-amino-6-hydroxy-2,6-dioxohexane-1-diazonium

(5S)-5-amino-6-hydroxy-2,6-dioxohexane-1-diazonium

C6H10N3O3+ (172.0722)


   

5-Guanidino-2-oxopentanoate

5-Guanidino-2-oxopentanoate

C6H10N3O3- (172.0722)


   

Metronidazole(1+)

Metronidazole(1+)

C6H10N3O3+ (172.0722)


An organic cation resulting from the addition of a proton to metronidazole.

   

Hexahydro[1,2,4]triazino[5,6-E][1,2,4]triazine-3,6(2H,4H)-dione

Hexahydro[1,2,4]triazino[5,6-E][1,2,4]triazine-3,6(2H,4H)-dione

C4H8N6O2 (172.0709)


   
   

diethylmaleate

diethyl maleate

C8H12O4 (172.0736)


   

Ethyl 2,4-dioxohexanoate

Ethyl 2,4-dioxohexanoate

C8H12O4 (172.0736)


   

trans-3-Octenedioic acid

trans-3-Octenedioic acid

C8H12O4 (172.0736)


   

5-(4-Hydroxybutyl)imidazolidine-2,4-dione

5-(4-Hydroxybutyl)imidazolidine-2,4-dione

C7H12N2O3 (172.0848)


   

suberate(2-)

suberate(2-)

C8H12O4 (172.0736)


A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of suberic acid; major species at pH 7.3.

   

Gly-pro

Gly-pro

C7H12N2O3 (172.0848)


A dipeptide consisting of L-proline having a glycyl residue attached to its alpha-amino group.

   

Gly-Pro zwitterion

Gly-Pro zwitterion

C7H12N2O3 (172.0848)


A peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Gly-Pro.

   

Octenedioic acid

Octenedioic acid

C8H12O4 (172.0736)


   

Dioxooctanoic acid

Dioxooctanoic acid

C8H12O4 (172.0736)


   

Cyclo(Ala-Thr)

Cyclo(Ala-Thr)

C7H12N2O3 (172.0848)


   

(2r)-2,4-dimethoxy-2-methyl-6h-pyran-3-one

(2r)-2,4-dimethoxy-2-methyl-6h-pyran-3-one

C8H12O4 (172.0736)


   

(4s,5r)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one

(4s,5r)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one

C8H12O4 (172.0736)


   

2-hydroxy-6-(hydroxymethyl)-2-methyl-3,6-dihydropyran-4-carbaldehyde

2-hydroxy-6-(hydroxymethyl)-2-methyl-3,6-dihydropyran-4-carbaldehyde

C8H12O4 (172.0736)


   

3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

C8H12O4 (172.0736)


   

4-(hydroxymethyl)-5-methoxy-3,5-dimethylfuran-2-one

4-(hydroxymethyl)-5-methoxy-3,5-dimethylfuran-2-one

C8H12O4 (172.0736)


   

(2e)-5-(acetyloxy)-3-methylpent-2-enoic acid

(2e)-5-(acetyloxy)-3-methylpent-2-enoic acid

C8H12O4 (172.0736)


   

5-(acetyloxy)-3-methylpent-2-enoic acid

5-(acetyloxy)-3-methylpent-2-enoic acid

C8H12O4 (172.0736)


   

(4r,5r)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one

(4r,5r)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one

C8H12O4 (172.0736)


   

4-hydroxy-5-[(1s,2e)-1-hydroxybut-2-en-1-yl]oxolan-2-one

4-hydroxy-5-[(1s,2e)-1-hydroxybut-2-en-1-yl]oxolan-2-one

C8H12O4 (172.0736)


   

(1-carboxyeth-1-en-1-yl)(2-methylpropyl-oxo-λ⁵-azanylidene)amine

(1-carboxyeth-1-en-1-yl)(2-methylpropyl-oxo-λ⁵-azanylidene)amine

C7H12N2O3 (172.0848)


   

4-hydroxy-5-(1-hydroxybut-2-en-1-yl)oxolan-2-one

4-hydroxy-5-(1-hydroxybut-2-en-1-yl)oxolan-2-one

C8H12O4 (172.0736)


   

2,5,8,11-tetraoxatricyclo[7.3.0.0³,⁷]dodecane

2,5,8,11-tetraoxatricyclo[7.3.0.0³,⁷]dodecane

C8H12O4 (172.0736)


   

methyl 1-hydroxy-4-oxocyclohexane-1-carboxylate

methyl 1-hydroxy-4-oxocyclohexane-1-carboxylate

C8H12O4 (172.0736)


   

(3as,7ar)-3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

(3as,7ar)-3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

C8H12O4 (172.0736)


   

(5s)-2-hydroxy-5-isopropyl-3-methoxy-5h-imidazol-4-one

(5s)-2-hydroxy-5-isopropyl-3-methoxy-5h-imidazol-4-one

C7H12N2O3 (172.0848)


   

4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one

4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one

C8H12O4 (172.0736)


   

(3as,4r,7as)-3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

(3as,4r,7as)-3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

C8H12O4 (172.0736)


   

(3ar,4r,7ar)-3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

(3ar,4r,7ar)-3a,4-dihydroxy-hexahydro-1-benzofuran-6-one

C8H12O4 (172.0736)


   

(5s)-5-hydroxy-5-isopropyl-4-methoxyfuran-2-one

(5s)-5-hydroxy-5-isopropyl-4-methoxyfuran-2-one

C8H12O4 (172.0736)


   

2-(propan-2-ylidene)pentanedioic acid

2-(propan-2-ylidene)pentanedioic acid

C8H12O4 (172.0736)


   

2-hydroxy-5-isopropyl-3-methoxy-5h-imidazol-4-one

2-hydroxy-5-isopropyl-3-methoxy-5h-imidazol-4-one

C7H12N2O3 (172.0848)


   

2-hydroxy-5-(2-hydroxypropyl)-4-methyl-2h-furan-3-one

2-hydroxy-5-(2-hydroxypropyl)-4-methyl-2h-furan-3-one

C8H12O4 (172.0736)


   

(1s,2r,5s,6r)-5,6-dihydroxy-2-methylcyclohex-3-ene-1-carboxylic acid

(1s,2r,5s,6r)-5,6-dihydroxy-2-methylcyclohex-3-ene-1-carboxylic acid

C8H12O4 (172.0736)


   

5-hydroxy-5-isopropyl-4-methoxyfuran-2-one

5-hydroxy-5-isopropyl-4-methoxyfuran-2-one

C8H12O4 (172.0736)


   

(4r,6s)-4,6-dihydroxy-6-(2-hydroxyethyl)cyclohex-2-en-1-one

(4r,6s)-4,6-dihydroxy-6-(2-hydroxyethyl)cyclohex-2-en-1-one

C8H12O4 (172.0736)


   

5,6-dihydroxy-2-methylcyclohex-3-ene-1-carboxylic acid

5,6-dihydroxy-2-methylcyclohex-3-ene-1-carboxylic acid

C8H12O4 (172.0736)


   

(4r,5s)-4-hydroxy-5-[(1s,2e)-1-hydroxybut-2-en-1-yl]oxolan-2-one

(4r,5s)-4-hydroxy-5-[(1s,2e)-1-hydroxybut-2-en-1-yl]oxolan-2-one

C8H12O4 (172.0736)


   

(5s)-4-(hydroxymethyl)-5-methoxy-3,5-dimethylfuran-2-one

(5s)-4-(hydroxymethyl)-5-methoxy-3,5-dimethylfuran-2-one

C8H12O4 (172.0736)


   

(4r,8s)-4,8-dimethyl-1,5-dioxocane-2,6-dione

(4r,8s)-4,8-dimethyl-1,5-dioxocane-2,6-dione

C8H12O4 (172.0736)