Exact Mass: 202.0906218

Exact Mass Matches: 202.0906218

Found 203 metabolites which its exact mass value is equals to given mass value 202.0906218, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Goltix

4-amino-3-methyl-6-phenyl-4,5-dihydro-1,2,4-triazin-5-one

C10H10N4O (202.085457)


CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6698; ORIGINAL_PRECURSOR_SCAN_NO 6696 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6758; ORIGINAL_PRECURSOR_SCAN_NO 6757 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3205; ORIGINAL_PRECURSOR_SCAN_NO 3203 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3208; ORIGINAL_PRECURSOR_SCAN_NO 3206 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6726; ORIGINAL_PRECURSOR_SCAN_NO 6725 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6740; ORIGINAL_PRECURSOR_SCAN_NO 6738 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6706; ORIGINAL_PRECURSOR_SCAN_NO 6705 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6743; ORIGINAL_PRECURSOR_SCAN_NO 6739 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 83 CONFIDENCE standard compound; EAWAG_UCHEM_ID 58 CONFIDENCE standard compound; INTERNAL_ID 4017 CONFIDENCE standard compound; INTERNAL_ID 8401 CONFIDENCE standard compound; INTERNAL_ID 2316 CONFIDENCE standard compound; INTERNAL_ID 3538

   

Diethyl oxalpropionate

Butanedioic acid, 2-methyl-3-oxo-, 1,4-diethyl ester

C9H14O5 (202.08411940000002)


Diethyl oxalpropionate, also known as methyloxalacetic acid diethyl ester or diethyl methyloxalacetate, is a member of the class of compounds known as beta-keto acids and derivatives. These compounds are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom. Diethyl oxalpropionate is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Within the cell, diethyl oxalpropionate is primarily located in the cytoplasm. Diethyl oxalpropionate is an intermediate for poly((R,S)-3,3-dimethylmalic acid) (PDMMLA) derivative synthesis. PDMMLA derivative can be used in synthesis of nanoparticles and study of warfarin encapsulation and controlled release[1].

   

Proclavaminate

Proclavaminic acid

C8H14N2O4 (202.0953524)


   

L-Coprine

2-amino-4-[(1-hydroxycyclopropyl)-C-hydroxycarbonimidoyl]butanoic acid

C8H14N2O4 (202.0953524)


L-Coprine is found in mushrooms. L-Coprine is present in the moderately toxic ink cap mushroom Coprinus atramentarius (common ink cap). Produces an oversensitivity to ethanol in some people Present in the mod. toxic ink cap mushroom Coprinus atramentarius (common ink cap). Produces an oversensitivity to ethanol in some people. L-Coprine is found in mushrooms.

   

Tremetone

Ethanone, 1-(2,3-dihydro-2-(1-methylethenyl)-5-benzofuranyl)-, (R)- (9CI)

C13H14O2 (202.09937440000002)


   

6-Acetyl-2,2-dimethyl-2H-1-benzopyran

1-(2,2-Dimethyl-2H-1-benzopyran-6-yl)ethanone, 9CI

C13H14O2 (202.09937440000002)


6-Acetyl-2,2-dimethyl-2H-1-benzopyran is a 1-benzopyran. 1-(2,2-Dimethylchromen-6-yl)ethanone is a natural product found in Ageratina altissima, Viguiera pazensis, and other organisms with data available. 6-Acetyl-2,2-dimethyl-2H-1-benzopyran is found in fats and oils. 6-Acetyl-2,2-dimethyl-2H-1-benzopyran is a constituent of Helianthus annuus (sunflower) Constituent of Helianthus annuus (sunflower). 6-Acetyl-2,2-dimethyl-2H-1-benzopyran is found in sunflower and fats and oils. Demethoxyencecalin is a chromene isolated from Helianthus annuus, has antifungal activities[1].

   

Prolyl-Serine

3-Hydroxy-2-{[hydroxy(pyrrolidin-2-yl)methylidene]amino}propanoate

C8H14N2O4 (202.0953524)


Prolyl-Serine is a dipeptide composed of proline and serine. 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

Alanylhydroxyproline

(2S,4R)-1-[(2S)-2-aminopropanoyl]-4-hydroxypyrrolidine-2-carboxylic acid

C8H14N2O4 (202.0953524)


Alanylhydroxyproline is a dipeptide composed of alanine and hydroxyproline. 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.

   

Hydroxyprolyl-Alanine

2-{[hydroxy(4-hydroxypyrrolidin-2-yl)methylidene]amino}propanoate

C8H14N2O4 (202.0953524)


Hydroxyprolyl-Alanine is a dipeptide composed of hydroxyproline and alanine. 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

Serylproline

(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid

C8H14N2O4 (202.0953524)


Serylproline is a dipeptide composed of serine and proline. 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.

   

3-(3-Methylbutylidene)-1(3H)-isobenzofuranone

(3Z)-3-(3-methylbutylidene)-1,3-dihydro-2-benzofuran-1-one

C13H14O2 (202.09937440000002)


Minor odorous constituent of celery (Apium graveolens). 3-(3-Methylbutylidene)-1(3H)-isobenzofuranone is found in wild celery and green vegetables. 3-(3-Methylbutylidene)-1(3H)-isobenzofuranone is found in green vegetables. Minor odorous constituent of celery (Apium graveolens

   

3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid

3-[(2Z)-1-hydroxybut-2-en-2-yl]pentanedioic acid

C9H14O5 (202.08411940000002)


3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid is found in fats and oils. 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid is a constituent of olives (Olea europaea). Constituent of olives (Olea europaea). 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid is found in fats and oils, herbs and spices, and fruits.

   

2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine

6,11-dimethyl-10-oxa-2,4,6-triazatricyclo[7.3.0.0³,⁷]dodeca-1,3(7),4,8,11-pentaen-5-amine

C10H10N4O (202.085457)


2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine is found in animal foods. 2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine is isolated from cooked meat Isolated from cooked meats. 2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine is found in animal foods.

   

Tremetone

1-[2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]ethan-1-one

C13H14O2 (202.09937440000002)


   

Ligujapone

(S)-3,4-Dihydro-6-hydroxy-3-(1-methylethenyl)-1(2H)-naphthalenone

C13H14O2 (202.09937440000002)


   
   

2,2-dimethyl-6-vinylchroman-4-one

2,2-dimethyl-6-vinylchroman-4-one

C13H14O2 (202.09937440000002)


   
   
   
   

diethyl 2-oxopentanedioate

Diethyl 2-oxopentane-1,5-dicarboxylate

C9H14O5 (202.08411940000002)


   

2,3-O-Isopropylidene-beta-D-Pyranose-1,6-Anhydromannose

2,3-O-Isopropylidene-beta-D-Pyranose-1,6-Anhydromannose

C9H14O5 (202.08411940000002)


   
   

(-)-(S,S)-Bisseton|(-)-bissetone|(2S,5S)-5-acetonyl-5-hydroxy-2-hydroxymethyltetrahydropyran-4-one|bissetone

(-)-(S,S)-Bisseton|(-)-bissetone|(2S,5S)-5-acetonyl-5-hydroxy-2-hydroxymethyltetrahydropyran-4-one|bissetone

C9H14O5 (202.08411940000002)


   

4-Acetyl-2-(3-methyl-1,3-butadienyl)phenol|4-Hydroxy-3-<3-methyl-butadien-(1,3)-yl>-acetophenon

4-Acetyl-2-(3-methyl-1,3-butadienyl)phenol|4-Hydroxy-3-<3-methyl-butadien-(1,3)-yl>-acetophenon

C13H14O2 (202.09937440000002)


   

5-Isopropyl-2-phenylthiophen

5-Isopropyl-2-phenylthiophen

C13H14S (202.0816164)


   

(+)-trideca-1,5t,11t-triene-7,9-diyne-3,4-diol|1,5,11-Tridecatriene-7,9-diyne-3,4-diol

(+)-trideca-1,5t,11t-triene-7,9-diyne-3,4-diol|1,5,11-Tridecatriene-7,9-diyne-3,4-diol

C13H14O2 (202.09937440000002)


   

(2S)-Tridec-trans-3-en-5.7.9-triin-1.2-diol|(S)-(E)-3-Tridecene-5,7,9-triyne-1,2-diol|(S)-tridec-3t-ene-5,7,9-triyne-1,2-diol

(2S)-Tridec-trans-3-en-5.7.9-triin-1.2-diol|(S)-(E)-3-Tridecene-5,7,9-triyne-1,2-diol|(S)-tridec-3t-ene-5,7,9-triyne-1,2-diol

C13H14O2 (202.09937440000002)


   

1,2-dihydroxy-5(E)-tridecene-7,9,11-triyne

1,2-dihydroxy-5(E)-tridecene-7,9,11-triyne

C13H14O2 (202.09937440000002)


   
   
   

1,2-O-Isopropylidene,3,4-anhydro-beta-D-Tagatose,,

1,2-O-Isopropylidene,3,4-anhydro-beta-D-Tagatose,,

C9H14O5 (202.08411940000002)


   

SCHEMBL10154028

SCHEMBL10154028

C13H14S (202.0816164)


   
   

1,8-Dimethoxy-3-methylnaphthalene

1,8-Dimethoxy-3-methylnaphthalene

C13H14O2 (202.09937440000002)


   
   

1-Alcohol,Me ester-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|eutypinol|methyleutypinol

1-Alcohol,Me ester-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|eutypinol|methyleutypinol

C13H14O2 (202.09937440000002)


   

C9H14O5

NCGC00385958-01_C9H14O5_

C9H14O5 (202.08411940000002)


   
   

Diethyl 2-methyl-3-oxosuccinate

Diethyl 2-methyl-3-oxosuccinate

C9H14O5 (202.08411940000002)


   
   
   

Ala-hpro

2-[(4-hydroxypyrrolidin-2-yl)formamido]propanoic acid

C8H14N2O4 (202.0953524)


   

Hpro-ala

1-(2-aminopropanoyl)-4-hydroxypyrrolidine-2-carboxylic acid

C8H14N2O4 (202.0953524)


   

Pro-ser

1-(2-amino-3-hydroxypropanoyl)pyrrolidine-2-carboxylic acid

C8H14N2O4 (202.0953524)


A dipeptide formed from L-proline and L-serine residues.

   

Ser-pro

3-hydroxy-2-(pyrrolidin-2-ylformamido)propanoic acid

C8H14N2O4 (202.0953524)


A dipeptide formed from L-serine and L-proline residues.

   

Demethoxyencecalin

1-(2,2-Dimethyl-2H-1-benzopyran-6-yl)ethanone, 9CI

C13H14O2 (202.09937440000002)


Demethoxyencecalin is a chromene isolated from Helianthus annuus, has antifungal activities[1].

   

3-Isovalidenephthalide

(3Z)-3-(3-methylbutylidene)-1,3-dihydro-2-benzofuran-1-one

C13H14O2 (202.09937440000002)


   

3-(1-Hydroxymethyl-1-propenyl)glutaric acid

3-[(2Z)-1-hydroxybut-2-en-2-yl]pentanedioic acid

C9H14O5 (202.08411940000002)


   

2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine

6,11-dimethyl-10-oxa-2,4,6-triazatricyclo[7.3.0.0^{3,7}]dodeca-1(9),2,4,7,11-pentaen-5-amine

C10H10N4O (202.085457)


   

6-Ethynyl-4,4-Dimethyl-Thiochroman

6-Ethynyl-4,4-Dimethyl-Thiochroman

C13H14S (202.0816164)


   

Diisopropyl azodicarboxylate

Diisopropyl azodicarboxylate

C8H14N2O4 (202.0953524)


   
   

Diethyl 2-formylsuccinate

Butanedioic acid,2-formyl-, 1,4-diethyl ester

C9H14O5 (202.08411940000002)


   

3-(TRIMETHYLSILYL)ETHYNYLBENZALDEHYDE

3-(TRIMETHYLSILYL)ETHYNYLBENZALDEHYDE

C12H14OSi (202.08138739999998)


   

4-amino-5-pyridin-3-ylmethyl-h-pyrimidin-2-one

4-amino-5-pyridin-3-ylmethyl-h-pyrimidin-2-one

C10H10N4O (202.085457)


   

ETHYL 2-ACETOXY-2-METHYLACETOACETATE

ETHYL 2-ACETOXY-2-METHYLACETOACETATE

C9H14O5 (202.08411940000002)


   

Dimethyl Tetrahydropyran-4,4-dicarboxylate

Dimethyl Tetrahydropyran-4,4-dicarboxylate

C9H14O5 (202.08411940000002)


   

3-Pyridinamine,6-butoxy-, hydrochloride (1:1)

3-Pyridinamine,6-butoxy-, hydrochloride (1:1)

C9H15ClN2O (202.08728499999998)


   

4-(4-aminophenoxy)pyrimidin-2-amine

4-(4-aminophenoxy)pyrimidin-2-amine

C10H10N4O (202.085457)


   

4-[(1-Imidazolyl)methyl]phenylboronic acid

4-[(1-Imidazolyl)methyl]phenylboronic acid

C10H11BN2O2 (202.09135360000002)


   

β-D-Galactopyranose,1,6-anhydro-3,4-O-(1-methylethylidene)-

β-D-Galactopyranose,1,6-anhydro-3,4-O-(1-methylethylidene)-

C9H14O5 (202.08411940000002)


   

(2-Isobutyrylamino-acetylamino)-acetic acid

(2-Isobutyrylamino-acetylamino)-acetic acid

C8H14N2O4 (202.0953524)


   

2-(3-Chloroprop-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-Chloroprop-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C9H16BClO2 (202.0931816)


   

SPIRO[CHROMAN-2,1-CYCLOPENTAN]-4-ONE

SPIRO[CHROMAN-2,1-CYCLOPENTAN]-4-ONE

C13H14O2 (202.09937440000002)


   

5-ISOPROPYL-4-OXO-3,4-DIHYDROPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBONITRILE

5-ISOPROPYL-4-OXO-3,4-DIHYDROPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBONITRILE

C10H10N4O (202.085457)


   

4-phenylcyclohexene-1-carboxylic acid

4-phenylcyclohexene-1-carboxylic acid

C13H14O2 (202.09937440000002)


   

(3aR,5S,6S,6aR)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-5-carbaldehyde

(3aR,5S,6S,6aR)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-5-carbaldehyde

C9H14O5 (202.08411940000002)


   

2-[(TRIMETHYLSILYL)ETHYNYL]BENZALDEHYDE

2-[(TRIMETHYLSILYL)ETHYNYL]BENZALDEHYDE

C12H14OSi (202.08138739999998)


   

N1-(4-METHOXYPHENYL)-1,2-ETHANEDIAMINE

N1-(4-METHOXYPHENYL)-1,2-ETHANEDIAMINE

C9H15ClN2O (202.08728499999998)


   

3-Chloropropenyl-1-boronic acid pinacol ester,2-(3-Chloro-propenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

3-Chloropropenyl-1-boronic acid pinacol ester,2-(3-Chloro-propenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

C9H16BClO2 (202.0931816)


   

2-HYDROXY-3-P-TOLYL-CYCLOHEX-2-ENONE

2-HYDROXY-3-P-TOLYL-CYCLOHEX-2-ENONE

C13H14O2 (202.09937440000002)


   
   
   
   

2-(2-methylphenoxy)ethylhydrazine,hydrochloride

2-(2-methylphenoxy)ethylhydrazine,hydrochloride

C9H15ClN2O (202.08728499999998)


   

Dimethyl (4-hydroxy-2-butenyl) malonate

Dimethyl (4-hydroxy-2-butenyl) malonate

C9H14O5 (202.08411940000002)


   

4-(4-Methyl-4H-1,2,4-triazol-3-yl)piperidine hydrochloride

4-(4-Methyl-4H-1,2,4-triazol-3-yl)piperidine hydrochloride

C8H15ClN4 (202.09851799999998)


   

1-Benzyl-1H-pyrazole-4-boronic acid

(1-Benzyl-1H-pyrazol-4-yl)boronic acid

C10H11BN2O2 (202.09135360000002)


   
   

1H-Indole-3-acetonitrile, 5-fluoro-a,a-dimethyl

1H-Indole-3-acetonitrile, 5-fluoro-a,a-dimethyl

C12H11FN2 (202.0906218)


   

(2-[cyclohex-3-enyl]ethyl)dimethyl chlorosilane

(2-[cyclohex-3-enyl]ethyl)dimethyl chlorosilane

C10H19ClSi (202.09444839999998)


   
   

3-(1-(2-benzoxazolyl)hydrazino)propanenitrile

3-(1-(2-benzoxazolyl)hydrazino)propanenitrile

C10H10N4O (202.085457)


   

5-amino-1-phenylpyrazole-4-carboxamide

5-amino-1-phenylpyrazole-4-carboxamide

C10H10N4O (202.085457)


   

4-(Dimethylphenylsilyl)-3-butyn-2-one

4-(Dimethylphenylsilyl)-3-butyn-2-one

C12H14OSi (202.08138739999998)


   
   

5-(4-methylphenyl)cyclohexane-1,3-dione

5-(4-methylphenyl)cyclohexane-1,3-dione

C13H14O2 (202.09937440000002)


   

2-HYDROXY-4,4-DIMETHYL-3-PHENYLCYCLOPENT-2-ENONE

2-HYDROXY-4,4-DIMETHYL-3-PHENYLCYCLOPENT-2-ENONE

C13H14O2 (202.09937440000002)


   

1,4-dihydroxy-3,3,6,6-tetramethylpiperazine-2,5-dione

1,4-dihydroxy-3,3,6,6-tetramethylpiperazine-2,5-dione

C8H14N2O4 (202.0953524)


   

5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBOXAMIDE

5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBOXAMIDE

C10H10N4O (202.085457)


   

2,2-Dimethylbut-3-ynoic acid benzyl ester

2,2-Dimethylbut-3-ynoic acid benzyl ester

C13H14O2 (202.09937440000002)


   
   

4-Methoxy-6-phenyl-1,3,5-triazin-2-amine

4-Methoxy-6-phenyl-1,3,5-triazin-2-amine

C10H10N4O (202.085457)


   

(1-(P-TOLYL)-1H-PYRAZOL-4-YL)BORONIC ACID

(1-(P-TOLYL)-1H-PYRAZOL-4-YL)BORONIC ACID

C10H11BN2O2 (202.09135360000002)


   

N-(2-FLUOROPHENYL)-1,2-DIAMINOBENZENE

N-(2-FLUOROPHENYL)-1,2-DIAMINOBENZENE

C12H11FN2 (202.0906218)


   
   

2,5-Piperazinedione,3,6-bis(2-hydroxyethyl)-

2,5-Piperazinedione,3,6-bis(2-hydroxyethyl)-

C8H14N2O4 (202.0953524)


   

3-AZIDO-2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE

3-AZIDO-2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE

C10H10N4O (202.085457)


   

3-ALLYL-2-(ALLYLOXY)BENZALDEHYDE

3-ALLYL-2-(ALLYLOXY)BENZALDEHYDE

C13H14O2 (202.09937440000002)


   

2-hydroxypropyl prop-2-enoate,prop-2-enoic acid

2-hydroxypropyl prop-2-enoate,prop-2-enoic acid

C9H14O5 (202.08411940000002)


   

1,6-ANHYDRO-2,3-O-ISOPROPYLIDENE-β-D-MANNOPYRANOSE

1,6-ANHYDRO-2,3-O-ISOPROPYLIDENE-β-D-MANNOPYRANOSE

C9H14O5 (202.08411940000002)


   

Carbamicacid,(3-oxo-4-isoxazolidinyl)-,1,1-dimethyl ethyl ester,(S)-(9CI)

Carbamicacid,(3-oxo-4-isoxazolidinyl)-,1,1-dimethyl ethyl ester,(S)-(9CI)

C8H14N2O4 (202.0953524)


   

4-(Trimethysilyl)-ethynylbenzaldehyde

4-(Trimethysilyl)-ethynylbenzaldehyde

C12H14OSi (202.08138739999998)


   

Acrylic acid-hydroxypropyl acrylate copolymer

Acrylic acid-hydroxypropyl acrylate copolymer

C9H14O5 (202.08411940000002)


   

2-Methyl-2,6-diazaspiro[3.3]heptane oxalate

2-Methyl-2,6-diazaspiro[3.3]heptane oxalate

C8H14N2O4 (202.0953524)


   
   

S-3,6-bis(2-hydroxyethyl)piperazine-2,5-dione

S-3,6-bis(2-hydroxyethyl)piperazine-2,5-dione

C8H14N2O4 (202.0953524)


   
   

2-acetyl-2-ethyl-2,3-dihydro-1H-Inden-1-one

2-acetyl-2-ethyl-2,3-dihydro-1H-Inden-1-one

C13H14O2 (202.09937440000002)


   

1-(6-Methoxy-2-naphthyl)ethanol

1-(6-Methoxy-2-naphthyl)ethanol

C13H14O2 (202.09937440000002)


   

Pentanedioic acid, 3-acetyl-, 1,5-dimethyl ester

Pentanedioic acid, 3-acetyl-, 1,5-dimethyl ester

C9H14O5 (202.08411940000002)


   

1H-Pyrazole-3,5-diamine,4-(2-phenyldiazenyl)-

1H-Pyrazole-3,5-diamine,4-(2-phenyldiazenyl)-

C9H10N6 (202.09669000000002)


   

2-Fluoro-4-((4-methylpyridin-2-yl)methyl)pyridine

2-Fluoro-4-((4-methylpyridin-2-yl)methyl)pyridine

C12H11FN2 (202.0906218)


   

dimethyl 2-(3-oxobutyl)propanedioate

dimethyl 2-(3-oxobutyl)propanedioate

C9H14O5 (202.08411940000002)


   

(2E)-N-(4-BUTYLPHENYL)-2-(HYDROXYIMINO)ACETAMIDE

(2E)-N-(4-BUTYLPHENYL)-2-(HYDROXYIMINO)ACETAMIDE

C13H14O2 (202.09937440000002)


   
   

2-PIPERAZIN-1-YL-SUCCINIC ACID

2-PIPERAZIN-1-YL-SUCCINIC ACID

C8H14N2O4 (202.0953524)


   

n-acetyl-d-ala-d-ala

n-acetyl-d-ala-d-ala

C8H14N2O4 (202.0953524)


   

Benzenamine, 3-fluoro-5-(4-methyl-3-pyridinyl)- (9CI)

Benzenamine, 3-fluoro-5-(4-methyl-3-pyridinyl)- (9CI)

C12H11FN2 (202.0906218)


   

4-amino-2-phenyl-1H-imidazole-5-carboxamide

4-amino-2-phenyl-1H-imidazole-5-carboxamide

C10H10N4O (202.085457)


   
   

[2-(2-methoxy-phenyl)-ethyl]-hydrazine hydrochloride

[2-(2-methoxy-phenyl)-ethyl]-hydrazine hydrochloride

C9H15ClN2O (202.08728499999998)


   

4-(1,2,4-Triazol-4-yl)acetanilide

4-(1,2,4-Triazol-4-yl)acetanilide

C10H10N4O (202.085457)


   

1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)ethanone

1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)ethanone

C10H10N4O (202.085457)


   

1-(4-methoxyphenethyl)hydrazine hydrochloride

1-(4-methoxyphenethyl)hydrazine hydrochloride

C9H15ClN2O (202.08728499999998)


   

4-Methyl-5-oxooctanedioic acid

4-Methyl-5-oxooctanedioic acid

C9H14O5 (202.08411940000002)


   

Amezinium

Amezinium

C11H12N3O+ (202.09803219999998)


D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors

   
   

(2S,3R)-5-azaniumyl-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoate

(2S,3R)-5-azaniumyl-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoate

C8H14N2O4 (202.0953524)


   

2,6-Diamino-4-methylideneheptanedioic acid

2,6-Diamino-4-methylideneheptanedioic acid

C8H14N2O4 (202.0953524)


   

2,6-Bis(azaniumyl)-4-methylideneheptanedioate

2,6-Bis(azaniumyl)-4-methylideneheptanedioate

C8H14N2O4 (202.0953524)


   

(2S)-2-[(4S)-4-amino-4-carboxybutyl]aziridine-2-carboxylic acid

(2S)-2-[(4S)-4-amino-4-carboxybutyl]aziridine-2-carboxylic acid

C8H14N2O4 (202.0953524)


   

Alaninylhydroxyproline

Alaninylhydroxyproline

C8H14N2O4 (202.0953524)


   

10-Amino-7-methyl-2-aza-7-azoniatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),7,9-pentaen-11-ol

10-Amino-7-methyl-2-aza-7-azoniatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),7,9-pentaen-11-ol

C11H12N3O+ (202.09803219999998)


   

N-(4-quinazolinyl)acetohydrazide

N-(4-quinazolinyl)acetohydrazide

C10H10N4O (202.085457)


   

7-Amino-1-methyl-8-oxo-3,4,5,8-tetrahydropyrrolo[4,3,2-de]quinolin-1-ium

7-Amino-1-methyl-8-oxo-3,4,5,8-tetrahydropyrrolo[4,3,2-de]quinolin-1-ium

C11H12N3O+ (202.09803219999998)


   

1-(2-amino-3-hydroxypropanoyl)pyrrolidine-2-carboxylic acid

1-(2-amino-3-hydroxypropanoyl)pyrrolidine-2-carboxylic acid

C8H14N2O4 (202.0953524)


   

4,6,8-Trimethylazulene-1,5-diol

4,6,8-Trimethylazulene-1,5-diol

C13H14O2 (202.09937440000002)


   

2,3,7-Trimethyl-2,3-methanochroman-4-one

2,3,7-Trimethyl-2,3-methanochroman-4-one

C13H14O2 (202.09937440000002)


   

1,1a,7,7a-Tetrahydro-1a,7a-dimethyl-7-methylenebenzo[b]cyclopropa[e]thiopyran

1,1a,7,7a-Tetrahydro-1a,7a-dimethyl-7-methylenebenzo[b]cyclopropa[e]thiopyran

C13H14S (202.0816164)


   

ethyl ethoxalylpropionate

Diethyl 2-methyl-3-oxosuccinate

C9H14O5 (202.08411940000002)


Diethyl oxalpropionate is an intermediate for poly((R,S)-3,3-dimethylmalic acid) (PDMMLA) derivative synthesis. PDMMLA derivative can be used in synthesis of nanoparticles and study of warfarin encapsulation and controlled release[1].

   
   

N(5)-(1-Hydroxycyclopropyl)-L-glutamine

N(5)-(1-Hydroxycyclopropyl)-L-glutamine

C8H14N2O4 (202.0953524)


   

Goltix

METAMITRON

C10H10N4O (202.085457)


   

3-(3-Methylbutylidene)-1(3H)-isobenzofuranone

3-(3-Methylbutylidene)-1(3H)-isobenzofuranone

C13H14O2 (202.09937440000002)


   

Hydroxyprolyl-Alanine

Hydroxyprolyl-Alanine

C8H14N2O4 (202.0953524)


   

3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid

3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid

C9H14O5 (202.08411940000002)


   

Alanyl-Hydroxyproline

Alanyl-Hydroxyproline

C8H14N2O4 (202.0953524)


   

Indole-3-butyrate

Indole-3-butyrate

C12H12NO2 (202.0867992)


An indol-3-yl carboxylic acid anion that is the conjugate base of indole-3-butyric acid, arising from the deprotonation of the carboxy group.

   

Coprine

Coprine

C8H14N2O4 (202.0953524)


A non-proteinogenic L-alpha-amino acid that is L-glutamine in which one of the hydrogens attached to the amide nitrogen is replaced by a 1-hydroxycyclopropyl group. Found in the ink-cap mushroom, Coprinus atramentarius, it causes an unpleasant hypersensitivity to alcohol (the disulfiram effect).

   

proclavaminic acid zwitterion

proclavaminic acid zwitterion

C8H14N2O4 (202.0953524)


Zwitterionic form of proclavaminic acid.

   

Hydroxymethylpropenyl)pentanedioic acid

Hydroxymethylpropenyl)pentanedioic acid

C9H14O5 (202.08411940000002)


   
   
   
   
   

ABT-418 (hydrochloride)

ABT-418 (hydrochloride)

C9H15ClN2O (202.08728499999998)


ABT-418 hydrochloride is a potent and selective agonist of nAChRs with cognitive enhancing and anxiolytic activities. ABT-418 hydrochloride activates cholinergic channel and can be used for research of Alzheimer's disease[1][2].

   

6-ethenyl-2,2-dimethyl-3h-1-benzopyran-4-one

6-ethenyl-2,2-dimethyl-3h-1-benzopyran-4-one

C13H14O2 (202.09937440000002)


   

(2s)-2-amino-4-[(1-hydroxycyclopropyl)-c-hydroxycarbonimidoyl]butanoic acid

(2s)-2-amino-4-[(1-hydroxycyclopropyl)-c-hydroxycarbonimidoyl]butanoic acid

C8H14N2O4 (202.0953524)


   
   

trideca-1,5,11-trien-7,9-diyne-3,4-diol

trideca-1,5,11-trien-7,9-diyne-3,4-diol

C13H14O2 (202.09937440000002)


   

1-(5-ethenyl-2-hydroxyphenyl)-3-methylbut-2-en-1-one

1-(5-ethenyl-2-hydroxyphenyl)-3-methylbut-2-en-1-one

C13H14O2 (202.09937440000002)


   

2-(2-thienylidene)-1,6-dioxaspiro[4.5]dec-3-ene

NA

C13H14O2 (202.09937440000002)


{"Ingredient_id": "HBIN003785","Ingredient_name": "2-(2-thienylidene)-1,6-dioxaspiro[4.5]dec-3-ene","Alias": "NA","Ingredient_formula": "C13H14O2","Ingredient_Smile": "NA","Ingredient_weight": "234.318","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9077","PubChem_id": "NA","DrugBank_id": "NA"}

   

(5s)-5-methyl-3-(6-methylhepta-1,5-dien-3-yn-2-yl)-5h-furan-2-one

(5s)-5-methyl-3-(6-methylhepta-1,5-dien-3-yn-2-yl)-5h-furan-2-one

C13H14O2 (202.09937440000002)


   

4a,5,7-trihydroxy-7-methyl-tetrahydro-1h-cyclopenta[c]pyran-3-one

4a,5,7-trihydroxy-7-methyl-tetrahydro-1h-cyclopenta[c]pyran-3-one

C9H14O5 (202.08411940000002)


   

5-(acetyloxy)-2-oxopentyl acetate

5-(acetyloxy)-2-oxopentyl acetate

C9H14O5 (202.08411940000002)


   

(5s)-5-ethyl-3-(4-methylphenyl)-5h-furan-2-one

(5s)-5-ethyl-3-(4-methylphenyl)-5h-furan-2-one

C13H14O2 (202.09937440000002)


   

[(1r,4r,5s)-4,5-dihydroxy-2-(hydroxymethyl)-3-methylcyclopent-2-en-1-yl]acetic acid

[(1r,4r,5s)-4,5-dihydroxy-2-(hydroxymethyl)-3-methylcyclopent-2-en-1-yl]acetic acid

C9H14O5 (202.08411940000002)


   

(4r,5r)-4-hydroxy-5-(2-hydroxyethyl)-2-(hydroxymethyl)cyclopent-1-ene-1-carboxylic acid

(4r,5r)-4-hydroxy-5-(2-hydroxyethyl)-2-(hydroxymethyl)cyclopent-1-ene-1-carboxylic acid

C9H14O5 (202.08411940000002)


   

(1r,4s,5r,6s,7r,11s)-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol

(1r,4s,5r,6s,7r,11s)-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol

C9H14O5 (202.08411940000002)


   

(5r)-3-[(1s,2r)-1,2-dihydroxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one

(5r)-3-[(1s,2r)-1,2-dihydroxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one

C9H14O5 (202.08411940000002)


   

2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol

2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol

C9H14O5 (202.08411940000002)


   

1-[4-hydroxy-3-(3-methylbuta-1,3-dien-1-yl)phenyl]ethanone

1-[4-hydroxy-3-(3-methylbuta-1,3-dien-1-yl)phenyl]ethanone

C13H14O2 (202.09937440000002)


   

(4as,5r,7s,7ar)-4a,5,7-trihydroxy-7-methyl-tetrahydro-1h-cyclopenta[c]pyran-3-one

(4as,5r,7s,7ar)-4a,5,7-trihydroxy-7-methyl-tetrahydro-1h-cyclopenta[c]pyran-3-one

C9H14O5 (202.08411940000002)


   

(2s,3as,6r,6ar)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-tetrahydrofuro[2,3-c]furan-4-one

(2s,3as,6r,6ar)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-tetrahydrofuro[2,3-c]furan-4-one

C9H14O5 (202.08411940000002)


   

5-methyl-3-(6-methylhepta-1,5-dien-3-yn-2-yl)-5h-furan-2-one

5-methyl-3-(6-methylhepta-1,5-dien-3-yn-2-yl)-5h-furan-2-one

C13H14O2 (202.09937440000002)


   

6-hydroxy-3-(prop-1-en-2-yl)-3,4-dihydro-2h-naphthalen-1-one

6-hydroxy-3-(prop-1-en-2-yl)-3,4-dihydro-2h-naphthalen-1-one

C13H14O2 (202.09937440000002)


   

(5r)-5-hydroxy-4-methoxy-5-[(2r)-1-methoxypropan-2-yl]furan-2-one

(5r)-5-hydroxy-4-methoxy-5-[(2r)-1-methoxypropan-2-yl]furan-2-one

C9H14O5 (202.08411940000002)


   

5-ethyl-3-(4-methylphenyl)-5h-furan-2-one

5-ethyl-3-(4-methylphenyl)-5h-furan-2-one

C13H14O2 (202.09937440000002)


   

(1r,4s,5s,6s,7r,11s)-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol

(1r,4s,5s,6s,7r,11s)-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol

C9H14O5 (202.08411940000002)


   

4-hydroxy-5-(2-hydroxyethyl)-2-(hydroxymethyl)cyclopent-1-ene-1-carboxylic acid

4-hydroxy-5-(2-hydroxyethyl)-2-(hydroxymethyl)cyclopent-1-ene-1-carboxylic acid

C9H14O5 (202.08411940000002)


   

4-hydroxy-5-(1-hydroxyethyl)-3-(2-hydroxypropylidene)oxolan-2-one

4-hydroxy-5-(1-hydroxyethyl)-3-(2-hydroxypropylidene)oxolan-2-one

C9H14O5 (202.08411940000002)


   

(5r)-3-methyl-5-[(1s,2r,3r)-1,2,3-trihydroxybutyl]-5h-furan-2-one

(5r)-3-methyl-5-[(1s,2r,3r)-1,2,3-trihydroxybutyl]-5h-furan-2-one

C9H14O5 (202.08411940000002)


   

(2r,3as,6r,6ar)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-tetrahydrofuro[2,3-c]furan-4-one

(2r,3as,6r,6ar)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-tetrahydrofuro[2,3-c]furan-4-one

C9H14O5 (202.08411940000002)


   

1-[(2s)-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]ethanone

1-[(2s)-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]ethanone

C13H14O2 (202.09937440000002)


   

6-methyl-2-(prop-1-en-1-yl)-2,3-dihydro-1-benzopyran-4-one

6-methyl-2-(prop-1-en-1-yl)-2,3-dihydro-1-benzopyran-4-one

C13H14O2 (202.09937440000002)


   

(3s,4s,5e,11e)-trideca-1,5,11-trien-7,9-diyne-3,4-diol

(3s,4s,5e,11e)-trideca-1,5,11-trien-7,9-diyne-3,4-diol

C13H14O2 (202.09937440000002)


   

(3s)-6-hydroxy-3-(prop-1-en-2-yl)-3,4-dihydro-2h-naphthalen-1-one

(3s)-6-hydroxy-3-(prop-1-en-2-yl)-3,4-dihydro-2h-naphthalen-1-one

C13H14O2 (202.09937440000002)


   

(2s,4s,5s,10r)-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.0²,⁴]decane-5,10-diol

(2s,4s,5s,10r)-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.0²,⁴]decane-5,10-diol

C9H14O5 (202.08411940000002)


   

(5r)-3-[(1r,2s)-1,2-dihydroxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one

(5r)-3-[(1r,2s)-1,2-dihydroxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one

C9H14O5 (202.08411940000002)


   

3-(1,2-dihydroxypropyl)-5-(1-hydroxyethyl)-5h-furan-2-one

3-(1,2-dihydroxypropyl)-5-(1-hydroxyethyl)-5h-furan-2-one

C9H14O5 (202.08411940000002)


   

(4r,5r)-4-hydroxy-5-[(1r)-1-hydroxyethyl]-3-[(2s)-2-hydroxypropylidene]oxolan-2-one

(4r,5r)-4-hydroxy-5-[(1r)-1-hydroxyethyl]-3-[(2s)-2-hydroxypropylidene]oxolan-2-one

C9H14O5 (202.08411940000002)


   

[4-methoxy-3-(3-methylbut-3-en-1-yn-1-yl)phenyl]methanol

[4-methoxy-3-(3-methylbut-3-en-1-yn-1-yl)phenyl]methanol

C13H14O2 (202.09937440000002)


   

(4s,5r)-3-[(2r,3s)-2,3-dihydroxybutylidene]-4-hydroxy-5-methyloxolan-2-one

(4s,5r)-3-[(2r,3s)-2,3-dihydroxybutylidene]-4-hydroxy-5-methyloxolan-2-one

C9H14O5 (202.08411940000002)


   

1-{4-hydroxy-3-[(1e)-3-methylbuta-1,3-dien-1-yl]phenyl}ethanone

1-{4-hydroxy-3-[(1e)-3-methylbuta-1,3-dien-1-yl]phenyl}ethanone

C13H14O2 (202.09937440000002)


   

4-(4-methoxyphenyl)cyclohex-2-en-1-one

4-(4-methoxyphenyl)cyclohex-2-en-1-one

C13H14O2 (202.09937440000002)


   

3-methyl-5-(1,2,3-trihydroxybutyl)-5h-furan-2-one

3-methyl-5-(1,2,3-trihydroxybutyl)-5h-furan-2-one

C9H14O5 (202.08411940000002)