Exact Mass: 264.115

Exact Mass Matches: 264.115

Found 181 metabolites which its exact mass value is equals to given mass value 264.115, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Acetyl-N-formyl-5-methoxykynurenamine

N-[3-[2-(formylamino)-5-methoxyphenyl]-3-oxypropyl]-acetamide

C13H16N2O4 (264.111)


Acetyl-N-formyl-5-methoxykynurenamine (AFMK) results from the oxidative cleavage of the pyrrole ring during melatonin oxidation by myeloperoxidase (MPO), a superoxide anion (O)-dependent reaction. AFMK is also expected to be formed from oxidation catalyzed by the unspecific enzyme indoleamine-2,3-dioxygenase (IDO), found in a variety of cell types including monocyte/macrophage lineages. MPO- and IDO-catalyzed melatonin oxidation has the requirement of O in common, a species formed in large amounts in inflammatory conditions. The non-enzymatic formation of AFMK can also be expected by its direct reaction with highly reactive oxygen species, such as hydroxyl radical and singlet oxygen. Thus, we assume that AFMK is a product formed in a route of melatonin metabolism, especially active in inflammation. As AFMK is biologically more active on leukocytes than melatonin, the metabolizing of melatonin to AFMK at inflammatory sites possibly plays a role in immunomodulation. AFMK is found in the CSF of patients with meningitis, and in some samples at a remarkably high concentration, with AFMK found in some patients exceeding the concentration of melatonin normally found in serum. (PMID: 16150112) [HMDB] Acetyl-N-formyl-5-methoxykynurenamine (AFMK) results from the oxidative cleavage of the pyrrole ring during melatonin oxidation by myeloperoxidase (MPO), a superoxide anion (O)-dependent reaction. AFMK is also expected to be formed from oxidation catalyzed by the unspecific enzyme indoleamine-2,3-dioxygenase (IDO), found in a variety of cell types including monocyte/macrophage lineages. MPO- and IDO-catalyzed melatonin oxidation has the requirement of O in common, a species formed in large amounts in inflammatory conditions. The non-enzymatic formation of AFMK can also be expected by its direct reaction with highly reactive oxygen species, such as hydroxyl radical and singlet oxygen. Thus, we assume that AFMK is a product formed in a route of melatonin metabolism, especially active in inflammation. As AFMK is biologically more active on leukocytes than melatonin, the metabolizing of melatonin to AFMK at inflammatory sites possibly plays a role in immunomodulation. AFMK is found in the CSF of patients with meningitis, and in some samples at a remarkably high concentration. AFMK was also found in some patients to exceed the concentration of melatonin normally found in serum (PMID: 16150112).

   

Phenylacetylglutamine

(2S)-5-amino-5-oxo-2-[(2-phenylacetyl)amino]pentanoic acid

C13H16N2O4 (264.111)


Phenylacetylglutamine is a product formed from the conjugation of phenylacetate and glutamine. Technically, it is the amino acid acetylation product of phenylacetate (or phenylbutyrate after beta-oxidation). Phenylacetylglutamine is a normal constituent of human urine, but other mammals such as the dog, cat, rat, monkey, sheep, and horse do not excrete this compound. Phenylacetyl-CoA and L-glutamine react to form phenylacetylglutamine and coenzyme A. The enzyme (glutamine N-acetyl transferase) that catalyzes this reaction has been purified from human liver mitochondria and shown to be a polypeptide species distinct from glycine-N-acyltransferase. Phenylacetylglutamine is a major nitrogenous metabolite that accumulates in uremia (PMID: 2791363, 8972626). It has been shown that over 50\\\% of urine phenylacetylglutamine may be derived from kidney conjugation of free plasma phenylacetic acid and/or from the kidneys preferential filtration of conjugated phenylacetic acid (PMID: 6420430). Phenylacetylglutamine is a microbial metabolite found in Christensenellaceae, Lachnospiraceae and Ruminococcaceae (PMID: 26241311). Phenylacetylglutamine is a product formed by the conjugation of phenylacetate and glutamine. Technically it is the amino acid acetylation product of phenylacetate (or phenylbutyrate after beta-oxidation). Phenylacetylglutamine is a normal constituent of human urine, but other mammals including the dog, cat, rat, monkey, sheep and horse do not excrete this compound. Phenylacetyl CoA and glutamine react to form phenylacetyl glutamine and Coenzyme A. The enzyme (Glutamine N-acetyl transferase) that catalyzes this reaction has been purified from human liver mitochondria and shown to be a distinct polypeptide species from glycine-N-acyltransferase. Phenylacetylglutamine is a major nitrogenous metabolite that accumulates in uremia. (PMID: 2791363; PMID: 8972626). It has been shown that over 50\\\% of urine phenylacetylglutamine may be derived from kidney conjugation of free plasma phenylacetic acid and/or from the kidneys preferential filtration of conjugated phenylacetic acid (PMID: 6420430) Phenylacetylglutamine is a colonic microbial metabolite from amino acid fermentation.

   

Bluensidine

Bluensidine

C8H16N4O6 (264.107)


   

N(2)-phenylacetyl-L-glutaminate

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

C13H16N2O4 (264.111)


N(2)-phenylacetyl-L-glutaminate is considered to be practically insoluble (in water) and acidic

   

Ilicifolinoside A

2-{[(2Z)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


Ilicifolinoside A is found in alcoholic beverages. Ilicifolinoside A is a constituent of Vitis vinifera (wine grape). Constituent of Vitis vinifera (wine grape). Ilicifolinoside A is found in alcoholic beverages and fruits.

   

Cinnamyl cinnamate

(2E)-3-Phenylprop-2-en-1-yl (2Z)-3-phenylprop-2-enoic acid

C18H16O2 (264.115)


Cinnamyl cinnamate occurs in storax and Peruvian balsam. Cinnamyl cinnamate is a flavouring agent. Occurs in storax and Peruvian balsam. Flavouring agent

   

(Z)-2-Methyl-2-butene-1,4-diol 4-O-beta-D-Glucopyranoside

2-{[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


(Z)-2-Methyl-2-butene-1,4-diol 4-O-beta-D-Glucopyranoside is found in alcoholic beverages. (Z)-2-Methyl-2-butene-1,4-diol 4-O-beta-D-Glucopyranoside is a constituent of Vitis vinifera (wine grape). Constituent of Vitis vinifera (wine grape). (Z)-2-Methyl-2-butene-1,4-diol 4-O-beta-D-glucoside is found in alcoholic beverages and fruits.

   

di-Hydroxymelatonin

N-[2-(4,6-dihydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide

C13H16N2O4 (264.111)


di-Hydroxymelatonin is a metabolite of melatonin. Melatonin Listen/ˌmɛləˈtoʊnɪn/, also known chemically as N-acetyl-5-methoxytryptamine, is a naturally occurring compound found in animals, plants, and microbes. In animals, circulating levels of the hormone melatonin vary in a daily cycle, thereby allowing the entrainment of the circadian rhythms of several biological functions. (Wikipedia)

   

Carbocyclic 3-deazaadenosine

3-{4-amino-1H-imidazo[4,5-c]pyridin-1-yl}-5-(hydroxymethyl)cyclopentane-1,2-diol

C12H16N4O3 (264.1222)


   

Phenylacetyl glutaminate

4-Amino-5-oxo-5-[(2-phenylacetyl)oxy]pentanimidate

C13H16N2O4 (264.111)


   

12-DEOXYTANSHINQUINONE B

12-DEOXYTANSHINQUINONE B

C18H16O2 (264.115)


   

Papillosol

Dehydrojuncusol

C18H16O2 (264.115)


   

Sanguinolentaquinone

Sanguinolentaquinone

C13H16N2O4 (264.111)


   

Eccremocarpol B

Eccremocarpol B

C11H20O7 (264.1209)


   

Dihydroxerulin

(Z,E,E,E)-5-(2,4,6-Tetradecatriene-8,10-diynylidene)-2(5H)-furanone

C18H16O2 (264.115)


   
   

(R)-4-O-beta-D-glucopyranosyl-4-hydroxy-2-pentanone

(R)-4-O-beta-D-glucopyranosyl-4-hydroxy-2-pentanone

C11H20O7 (264.1209)


   

2t,4t-Undecadien-8,10-diinsaeure-4,6-heptadiinylester|4,6-Heptadiynyl ester-(2E,4E)-2,4-Undecadiene-8,10-diynoic acid

2t,4t-Undecadien-8,10-diinsaeure-4,6-heptadiinylester|4,6-Heptadiynyl ester-(2E,4E)-2,4-Undecadiene-8,10-diynoic acid

C18H16O2 (264.115)


   

5-Allyl-2-(4-hydroxyphenyl)-3-methylbenzofuran

5-Allyl-2-(4-hydroxyphenyl)-3-methylbenzofuran

C18H16O2 (264.115)


   

O1-((Xi)-1-methyl-butyl)-beta-D-glucopyranuronic acid|O1-((Xi)-1-Methyl-butyl)-beta-D-glucopyranuronsaeure

O1-((Xi)-1-methyl-butyl)-beta-D-glucopyranuronic acid|O1-((Xi)-1-Methyl-butyl)-beta-D-glucopyranuronsaeure

C11H20O7 (264.1209)


   

Ro 09-0680

Ro 09-0680

C18H16O2 (264.115)


   
   

CHEMBL4446582

CHEMBL4446582

C18H16O2 (264.115)


   

2-(4-methoxyphenyl)-5-((E)-1-propenyl)benzofuran|2-(4-methoxyphenyl)-5-(E)-propenylbenzofuran|rataniaphenol I

2-(4-methoxyphenyl)-5-((E)-1-propenyl)benzofuran|2-(4-methoxyphenyl)-5-(E)-propenylbenzofuran|rataniaphenol I

C18H16O2 (264.115)


   

13-Methyl-13,14,15,16-tetrahydro-12H-cyclopenta[a]phenanthrene-11,17-dione

13-Methyl-13,14,15,16-tetrahydro-12H-cyclopenta[a]phenanthrene-11,17-dione

C18H16O2 (264.115)


   

hedathiosulfonic acid A

hedathiosulfonic acid A

C12H24O2S2 (264.1218)


   

(E)-4-[3-methyl-5-(prop-1-enyl)benzo[b]furan-2-yl]phenol|4-[3-methyl-5-((E)-1-propenyl)-2-benzofuranyl]phenol|4-{3-methyl-5-[(1E)-prop-1-en-1-yl]-1-benzofuran-2-yl}phenol|Eupomatenoid 6|eupomatenoid-6|rataniaphenol II

(E)-4-[3-methyl-5-(prop-1-enyl)benzo[b]furan-2-yl]phenol|4-[3-methyl-5-((E)-1-propenyl)-2-benzofuranyl]phenol|4-{3-methyl-5-[(1E)-prop-1-en-1-yl]-1-benzofuran-2-yl}phenol|Eupomatenoid 6|eupomatenoid-6|rataniaphenol II

C18H16O2 (264.115)


   

Dehydrojuncuenin B

Dehydrojuncuenin B

C18H16O2 (264.115)


   

5,7a-dihydro-4-methoxy-5-(3-phenyl-2-propenylidene) benzofuran

5,7a-dihydro-4-methoxy-5-(3-phenyl-2-propenylidene) benzofuran

C18H16O2 (264.115)


   
   

Dehydrojuncusol

Dehydrojuncusol

C18H16O2 (264.115)


Dehydrojuncusol is a natural product found in Juncus effusus, Juncus acutus, and Juncus roemerianus with data available.

   

C11H20O7

NCGC00380816-01_C11H20O7_

C11H20O7 (264.1209)


   

Phenylacetylglutamine

N-[(4-Hydroxyphenyl)acetyl]glutamic acid

C13H16N2O4 (264.111)


Phenylacetylglutamine is a colonic microbial metabolite from amino acid fermentation.

   

N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine

N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; LC-tDDA; CE10

Phenylacetylglutamine; LC-tDDA; CE10

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; LC-tDDA; CE20

Phenylacetylglutamine; LC-tDDA; CE20

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; LC-tDDA; CE30

Phenylacetylglutamine; LC-tDDA; CE30

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; LC-tDDA; CE40

Phenylacetylglutamine; LC-tDDA; CE40

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; AIF; CE0; MS2Dec

Phenylacetylglutamine; AIF; CE0; MS2Dec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; AIF; CE10; MS2Dec

Phenylacetylglutamine; AIF; CE10; MS2Dec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; AIF; CE30; MS2Dec

Phenylacetylglutamine; AIF; CE30; MS2Dec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; AIF; CE0; CorrDec

Phenylacetylglutamine; AIF; CE0; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; AIF; CE10; CorrDec

Phenylacetylglutamine; AIF; CE10; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine; AIF; CE30; CorrDec

Phenylacetylglutamine; AIF; CE30; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine [M+Na]+; AIF; CE0; CorrDec

Phenylacetylglutamine [M+Na]+; AIF; CE0; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine [M+Na]+; AIF; CE10; CorrDec

Phenylacetylglutamine [M+Na]+; AIF; CE10; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine [M+Na]+; AIF; CE30; CorrDec

Phenylacetylglutamine [M+Na]+; AIF; CE30; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine [M+K]+; AIF; CE0; CorrDec

Phenylacetylglutamine [M+K]+; AIF; CE0; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine [M+K]+; AIF; CE10; CorrDec

Phenylacetylglutamine [M+K]+; AIF; CE10; CorrDec

C13H16N2O4 (264.111)


   

Phenylacetylglutamine [M+K]+; AIF; CE30; CorrDec

Phenylacetylglutamine [M+K]+; AIF; CE30; CorrDec

C13H16N2O4 (264.111)


   

PHENYLACETYL-GLUTAMINE

PHENYLACETYL-GLUTAMINE

C13H16N2O4 (264.111)


   

1-(5-Ketohexyl)-3-methylxanthine

1-(5-Ketohexyl)-3-methylxanthine

C12H16N4O3 (264.1222)


   

CAY10587

4-[2-(2-methylphenyl)ethynyl]-benzenepropanoic acid

C18H16O2 (264.115)


   

Styracin

(E)-3-phenylprop-2-enoic acid [(E)-3-phenylprop-2-enyl] ester

C18H16O2 (264.115)


   

Ilicifolinoside A

2-{[(2Z)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


   

(Z)-2-Methyl-2-butene-1,4-diol 4-O-beta-D-Glucopyranoside

2-{[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


   

1-(Benzyloxycarbonyl)piperazine-2-carboxylic acid

1-(Benzyloxycarbonyl)piperazine-2-carboxylic acid

C13H16N2O4 (264.111)


   

4-BORONO-2-(CYCLOHEXYLOXY)BENZOIC ACID

4-BORONO-2-(CYCLOHEXYLOXY)BENZOIC ACID

C13H17BO5 (264.1169)


   

(6-phenylmethoxynaphthalen-2-yl)methanol

(6-phenylmethoxynaphthalen-2-yl)methanol

C18H16O2 (264.115)


   

4-CHLORO-TRANS-BETA-STYRYLBORONIC ACID PINACOL ESTER

4-CHLORO-TRANS-BETA-STYRYLBORONIC ACID PINACOL ESTER

C14H18BClO2 (264.1088)


   

methyl 1-(4-nitrophenyl)piperidine-4-carboxylate

methyl 1-(4-nitrophenyl)piperidine-4-carboxylate

C13H16N2O4 (264.111)


   
   

3-(BOC-AMIDINO)-BENZOICACID

3-(BOC-AMIDINO)-BENZOICACID

C13H16N2O4 (264.111)


   

(2S,4S)-1-CBZ-4-AMINO PYRROLIDINE-2-CARBOXYLIC ACID

(2S,4S)-1-CBZ-4-AMINO PYRROLIDINE-2-CARBOXYLIC ACID

C13H16N2O4 (264.111)


   

(S)-1-(Benzyloxycarbonyl)hexahydropyridazine-3-carboxylic acid

(S)-1-(Benzyloxycarbonyl)hexahydropyridazine-3-carboxylic acid

C13H16N2O4 (264.111)


   

ETHYL 1-(TERT-BUTYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE

ETHYL 1-(TERT-BUTYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE

C11H15F3N2O2 (264.1086)


   

4-(Cyclohexylamino)-3-nitrobenzoic acid

4-(Cyclohexylamino)-3-nitrobenzoic acid

C13H16N2O4 (264.111)


   

TERT-BUTYL 6-AMINO-1,4-THIAZEPANE-4-CARBOXYLATE 1,1-DIOXIDE

TERT-BUTYL 6-AMINO-1,4-THIAZEPANE-4-CARBOXYLATE 1,1-DIOXIDE

C10H20N2O4S (264.1144)


   

TRANS-2-(3-CHLOROPHENYL)VINYLBORONIC AC&

TRANS-2-(3-CHLOROPHENYL)VINYLBORONIC AC&

C14H18BClO2 (264.1088)


   

4,4-DIPHENYL-CYCLOHEXANE-1,3-DIONE

4,4-DIPHENYL-CYCLOHEXANE-1,3-DIONE

C18H16O2 (264.115)


   

n-(4-nitrobenzyl)piperidine-4-carboxylic acid

n-(4-nitrobenzyl)piperidine-4-carboxylic acid

C13H16N2O4 (264.111)


   

1,1-but-2-ynylenedipyrrolidinium dichloride

1,1-but-2-ynylenedipyrrolidinium dichloride

C12H22Cl2N2 (264.116)


   

5-Methyl-5-veratrylhydantoin

5-Methyl-5-veratrylhydantoin

C13H16N2O4 (264.111)


   

ammonium tetraborate tetrahydrate

ammonium tetraborate tetrahydrate

B4H16N2O11 (264.1126)


   

4-(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)PIPERIDINE HYDROCHLORIDE

4-(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)PIPERIDINE HYDROCHLORIDE

C13H17ClN4 (264.1142)


   

2-tert-Butyl-9,10-anthraquinone

2-tert-Butyl-9,10-anthraquinone

C18H16O2 (264.115)


   

3-NITRO-4-(HEXAMETHYLENEIMIN-1-YL)BENZOIC ACID

3-NITRO-4-(HEXAMETHYLENEIMIN-1-YL)BENZOIC ACID

C13H16N2O4 (264.111)


   

2-(4-methylpiperidin-1-yl)-5-nitrobenzoic acid

2-(4-methylpiperidin-1-yl)-5-nitrobenzoic acid

C13H16N2O4 (264.111)


   

2-(3-NITROPHENYL)NICOTINIC ACID

2-(3-NITROPHENYL)NICOTINIC ACID

C13H16N2O4 (264.111)


   

Propanedioic acid,2-(2-phenylhydrazinylidene)-, 1,3-diethyl ester

Propanedioic acid,2-(2-phenylhydrazinylidene)-, 1,3-diethyl ester

C13H16N2O4 (264.111)


   
   

2-(Methacryloyloxy)ethyl 3,5-diaminobenzoate

2-(Methacryloyloxy)ethyl 3,5-diaminobenzoate

C13H16N2O4 (264.111)


   

4-(BOC-AMIDINO)-BENZOICACID

4-(BOC-AMIDINO)-BENZOICACID

C13H16N2O4 (264.111)


   

benzyl 4-nitropiperidine-1-carboxylate

benzyl 4-nitropiperidine-1-carboxylate

C13H16N2O4 (264.111)


   

DIETHYL 2-(3-CHLOROPROPYL)-2-ETHYLMALONATE

DIETHYL 2-(3-CHLOROPROPYL)-2-ETHYLMALONATE

C12H21ClO4 (264.1128)


   

4-Phenylmethoxycarbonyl-2-piperazinecarboxylic acid hydrochloride

4-Phenylmethoxycarbonyl-2-piperazinecarboxylic acid hydrochloride

C13H16N2O4 (264.111)


   

12-Bromo-1-dodecanol

12-Bromo-1-dodecanol

C12H25BrO (264.1089)


   

1-((Benzyloxy)carbonyl)hexahydropyridazine-3-carboxylic acid

1-((Benzyloxy)carbonyl)hexahydropyridazine-3-carboxylic acid

C13H16N2O4 (264.111)


   

N-(PIPERIDIN-4-YL)QUINOXALIN-2-AMINE HYDROCHLORIDE

N-(PIPERIDIN-4-YL)QUINOXALIN-2-AMINE HYDROCHLORIDE

C13H17ClN4 (264.1142)


   

Diethyl-[(3-pyridinylamino)methylen]malonat

Diethyl-[(3-pyridinylamino)methylen]malonat

C13H16N2O4 (264.111)


   

(2R,4R)-4-amino-1-benzylpyrrolidine-2,4-dicarboxylic acid

(2R,4R)-4-amino-1-benzylpyrrolidine-2,4-dicarboxylic acid

C13H16N2O4 (264.111)


   

N-Boc-5-aminoisoindoline

N-Boc-5-aminoisoindoline

C13H16N2O4 (264.111)


   

1-Ethyl-3-methylimidazolium diethyl phosphate

1-Ethyl-3-methylimidazolium diethyl phosphate

C10H21N2O4P (264.1239)


   

1-[4-(3-amino-4-nitrophenyl)piperazin-1-yl]ethanone

1-[4-(3-amino-4-nitrophenyl)piperazin-1-yl]ethanone

C12H16N4O3 (264.1222)


   

2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine 1,1-dioxide hydrochloride

2,3,4,5-tetrahydrobenzo[f][1,4]thiazepine 1,1-dioxide hydrochloride

C10H20N2O4S (264.1144)


   

4-N-CBZ-2-piperazine carboxylic acid

4-N-CBZ-2-piperazine carboxylic acid

C13H16N2O4 (264.111)


   

2-(4-FLUOROPHENYL)-4,5-DIHYDRO-2H-BENZO[G]INDAZOLE

2-(4-FLUOROPHENYL)-4,5-DIHYDRO-2H-BENZO[G]INDAZOLE

C17H13FN2 (264.1063)


   

4-(2-Methyl-1-piperidinyl)-3-nitrobenzoic acid

4-(2-Methyl-1-piperidinyl)-3-nitrobenzoic acid

C13H16N2O4 (264.111)


   

TERT-BUTYL 4-(METHYLSULFONYL)PIPERAZINE-1-CARBOXYLATE

TERT-BUTYL 4-(METHYLSULFONYL)PIPERAZINE-1-CARBOXYLATE

C10H20N2O4S (264.1144)


   

2-(1-(4-CHLOROPHENYL)VINYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

2-(1-(4-CHLOROPHENYL)VINYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

C14H18BClO2 (264.1088)


   

H-Leu-Pro-OH · HCl

(S)-1-((S)-2-Amino-4-methylpentanoyl)pyrrolidine-2-carboxylic acid hydrochloride

C11H21ClN2O3 (264.1241)


   

1,3,5,7-tetramethylanthracene-9,10-dione

1,3,5,7-tetramethylanthracene-9,10-dione

C18H16O2 (264.115)


   

(R)-4-(Benzyloxycarbonyl)piperazine-2-carboxylic acid

(R)-4-(Benzyloxycarbonyl)piperazine-2-carboxylic acid

C13H16N2O4 (264.111)


   

3-(N-Acetoaceto)amino-4-methoxyacetanilide

3-(N-Acetoaceto)amino-4-methoxyacetanilide

C13H16N2O4 (264.111)


   

diethyl 2-[(pyridin-2-ylamino)methylidene]propanedioate

diethyl 2-[(pyridin-2-ylamino)methylidene]propanedioate

C13H16N2O4 (264.111)


   

Iprazochrome

Hydrazinecarboxamide,2-[1,2,3,6-tetrahydro-3-hydroxy-1-(1-methylethyl)-6-oxo-5H-indol-5-ylidene]-

C12H16N4O3 (264.1222)


D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists N - Nervous system > N02 - Analgesics > N02C - Antimigraine preparations C78272 - Agent Affecting Nervous System > C66885 - Serotonin Antagonist

   

WARFARIN RELATED COMPOUND A (50 MG) (3-(O-HYDROXYPHENYL)-5-PHENYL-2-CYCLOHEXEN-1-ONE)

WARFARIN RELATED COMPOUND A (50 MG) (3-(O-HYDROXYPHENYL)-5-PHENYL-2-CYCLOHEXEN-1-ONE)

C18H16O2 (264.115)


   

1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-6-NITRO-,1,1-DIMETHYLETHYL ESTER

1H-INDOLE-1-CARBOXYLIC ACID,2,3-DIHYDRO-6-NITRO-,1,1-DIMETHYLETHYL ESTER

C13H16N2O4 (264.111)


   

5-BIPHENYL-4-YL-CYCLOHEXANE-1,3-DIONE

5-BIPHENYL-4-YL-CYCLOHEXANE-1,3-DIONE

C18H16O2 (264.115)


   

ETHYL 4-(DIETHOXYPHOSPHORYL)-3-METHYLBUT-2-ENOATE

ETHYL 4-(DIETHOXYPHOSPHORYL)-3-METHYLBUT-2-ENOATE

C11H21O5P (264.1127)


   

1-(4-FLUOROPHENYL)-3-(4-HYDROXYPHENYL)-2-PROPEN-1-ONE

1-(4-FLUOROPHENYL)-3-(4-HYDROXYPHENYL)-2-PROPEN-1-ONE

C17H13FN2 (264.1063)


   

1-Ethyl-3-methylimidazolium diethylphosphate

1-Ethyl-3-methylimidazolium diethylphosphate

C10H21N2O4P (264.1239)


   

(S)-1-((BENZYLOXY)CARBONYL)PIPERAZINE-2-CARBOXYLIC ACID

(S)-1-((BENZYLOXY)CARBONYL)PIPERAZINE-2-CARBOXYLIC ACID

C13H16N2O4 (264.111)


   

Ulodesine

Ulodesine

C12H16N4O3 (264.1222)


C471 - Enzyme Inhibitor > C2151 - Purine Nucleoside Phosphorylase Inhibitor

   

3-(10-Methyl-anthracen-9-YL)-propionic acid

3-(10-Methyl-anthracen-9-YL)-propionic acid

C18H16O2 (264.115)


   

Cinnyl Cinnamate

Cinnamyl cinnamate

C18H16O2 (264.115)


   

Eupomatenoid 6

Eupomatenoid 6

C18H16O2 (264.115)


   

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-morpholinecarboxamide

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-morpholinecarboxamide

C13H16N2O4 (264.111)


   

N-benzyloxycarbonyl-L-leucinate

N-benzyloxycarbonyl-L-leucinate

C14H18NO4- (264.1236)


   

S-(3-methylbutan-3-yl)-L-cysteinylglycine

S-(3-methylbutan-3-yl)-L-cysteinylglycine

C10H20N2O4S (264.1144)


   
   

N-pantoylglycyl-2-aminoethanethiol

N-pantoylglycyl-2-aminoethanethiol

C10H20N2O4S (264.1144)


   

2-[[(2R)-2-amino-3-(4-hydroxy-3-methylbutan-2-yl)sulfanylpropanoyl]amino]acetic acid

2-[[(2R)-2-amino-3-(4-hydroxy-3-methylbutan-2-yl)sulfanylpropanoyl]amino]acetic acid

C10H20N2O4S (264.1144)


   

2-[[(2R)-2-amino-3-(1-hydroxypentan-3-ylsulfanyl)propanoyl]amino]acetic acid

2-[[(2R)-2-amino-3-(1-hydroxypentan-3-ylsulfanyl)propanoyl]amino]acetic acid

C10H20N2O4S (264.1144)


   

3-sulfanylpentan-1-ol-[CysGly] conjugate

3-sulfanylpentan-1-ol-[CysGly] conjugate

C10H20N2O4S (264.1144)


   

S-(4-hydroxy-3-methylbutan-2-yl)-L-cysteinylglycine

S-(4-hydroxy-3-methylbutan-2-yl)-L-cysteinylglycine

C10H20N2O4S (264.1144)


   

(2-Phenylacetyl) 2,5-diamino-5-oxopentanoate

(2-Phenylacetyl) 2,5-diamino-5-oxopentanoate

C13H16N2O4 (264.111)


   

5,7-Dimethylspiro[cyclohexane-1,3-pyrimido[5,4-c][1,2,5]oxadiazine]-6,8-dione

5,7-Dimethylspiro[cyclohexane-1,3-pyrimido[5,4-c][1,2,5]oxadiazine]-6,8-dione

C12H16N4O3 (264.1222)


   

4-(tert-Butoxycarbonyl-hydrazonomethyl)-benzoic acid

4-(tert-Butoxycarbonyl-hydrazonomethyl)-benzoic acid

C13H16N2O4 (264.111)


   

2-Hydroxy-2-methyl-3-buten-1-yl beta-D-glucopyranoside

2-Hydroxy-2-methyl-3-buten-1-yl beta-D-glucopyranoside

C11H20O7 (264.1209)


   

(3R)-5-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxypentanoic acid

(3R)-5-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxypentanoic acid

C11H20O7 (264.1209)


   

(3S,4R)-4-[(2S,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxypentanoic acid

(3S,4R)-4-[(2S,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxypentanoic acid

C11H20O7 (264.1209)


   

8-(5-Hydroxypentyl)-7-methyllumazine

8-(5-Hydroxypentyl)-7-methyllumazine

C12H16N4O3 (264.1222)


   

AFMK

N-Acetyl-N-formyl-5-methoxykynurenamine

C13H16N2O4 (264.111)


   

N(2)-phenylacetylglutamine

N(2)-phenylacetylglutamine

C13H16N2O4 (264.111)


   

di-Hydroxymelatonin

di-Hydroxymelatonin

C13H16N2O4 (264.111)


   

rataniaphenol II

rataniaphenol II

C18H16O2 (264.115)


A member of the class of benzofurans that is 1-benzofuran substituted by a 4-hydroxyphenyl group at position 2, a methyl group at position 3 and a prop-1-en-1-yl group at position 5. It is a lignan derivative isolated from the roots of Krameria lappacea.

   

N(2)-phenylacetyl-L-glutamine

N(2)-phenylacetyl-L-glutamine

C13H16N2O4 (264.111)


An a N(2)-phenylacetylglutamine having L-configuration.

   

Cyclo(Thr-Tyr)

Cyclo(Thr-Tyr)

C13H16N2O4 (264.111)


   

MN-64

MN-64

C18H16O2 (264.115)


MN-64 is a potent tankyrase 1 inhibitor, with IC50s of 6 nM, 72 nM, 19.1 μM, and 39.4 μM for TNKS1, TNKS2, ARTD1 and ARTD2, respectively.

   

2-[(4-hydroxy-2-methylbut-2-en-1-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

2-[(4-hydroxy-2-methylbut-2-en-1-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


   

6-(3-methyl-6-phenylhexa-1,3,5-trien-1-yl)pyran-2-one

6-(3-methyl-6-phenylhexa-1,3,5-trien-1-yl)pyran-2-one

C18H16O2 (264.115)


   

(5z)-4-methoxy-5-[(2e)-3-phenylprop-2-en-1-ylidene]-7ah-1-benzofuran

(5z)-4-methoxy-5-[(2e)-3-phenylprop-2-en-1-ylidene]-7ah-1-benzofuran

C18H16O2 (264.115)


   

(5e,7as)-4-methoxy-5-[(2e)-3-phenylprop-2-en-1-ylidene]-7ah-1-benzofuran

(5e,7as)-4-methoxy-5-[(2e)-3-phenylprop-2-en-1-ylidene]-7ah-1-benzofuran

C18H16O2 (264.115)


   

1-(3-methylbut-2-en-1-yl)xanthen-9-one

1-(3-methylbut-2-en-1-yl)xanthen-9-one

C18H16O2 (264.115)


   

5-ethenyl-1,6-dimethylphenanthrene-2,7-diol

5-ethenyl-1,6-dimethylphenanthrene-2,7-diol

C18H16O2 (264.115)


   

5-(tetradeca-2,4,6-trien-8,10-diyn-1-ylidene)furan-2-one

5-(tetradeca-2,4,6-trien-8,10-diyn-1-ylidene)furan-2-one

C18H16O2 (264.115)


   

12-deoxydanshenxinkun b

NA

C18H16O2 (264.115)


{"Ingredient_id": "HBIN000779","Ingredient_name": "12-deoxydanshenxinkun b","Alias": "NA","Ingredient_formula": "C18H16O2","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5164","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

1,4-Di(p-tolyl)-trans-2-buten-1,4-dione

SMR000348978; NSC29008; 6N-770; ZINC00455623; (E)-1,4-bis(4-methylphenyl)but-2-ene-1,4-dione; Bionet2_000363; 5465-41-8; (2E)-1,4-Bis(4-methylphenyl)-2-butene-1,4-dione; 1,4-bis(4-methylphenyl)but-2-ene-1,4-dione; MLS001005669

C18H16O2 (264.115)


{"Ingredient_id": "HBIN001450","Ingredient_name": "1,4-Di(p-tolyl)-trans-2-buten-1,4-dione","Alias": "SMR000348978; NSC29008; 6N-770; ZINC00455623; (E)-1,4-bis(4-methylphenyl)but-2-ene-1,4-dione; Bionet2_000363; 5465-41-8; (2E)-1,4-Bis(4-methylphenyl)-2-butene-1,4-dione; 1,4-bis(4-methylphenyl)but-2-ene-1,4-dione; MLS001005669","Ingredient_formula": "C18H16O2","Ingredient_Smile": "CC1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=C(C=C2)C","Ingredient_weight": "264.32","OB_score": "39.89973397","CAS_id": "5465-41-8","SymMap_id": "SMIT10337","TCMID_id": "NA","TCMSP_id": "MOL009173","TCM_ID_id": "NA","PubChem_id": "883995","DrugBank_id": "NA"}

   

2,7-dihydroxy-1,6-dimethylpyrene

NA

C18H16O2 (264.115)


{"Ingredient_id": "HBIN005005","Ingredient_name": "2,7-dihydroxy-1,6-dimethylpyrene","Alias": "NA","Ingredient_formula": "C18H16O2","Ingredient_Smile": "CC1=C(C=CC2=C1C=CC3=CC(=C(C(=C32)C=C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5860","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-isopropyl-8-methyl-3,4-phenanthraquinone

NA

C18H16O2 (264.115)


{"Ingredient_id": "HBIN005859","Ingredient_name": "2-isopropyl-8-methyl-3,4-phenanthraquinone","Alias": "NA","Ingredient_formula": "C18H16O2","Ingredient_Smile": "NA","Ingredient_weight": "264.32","OB_score": "NA","CAS_id": "87112-49-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8597","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-isopropyl-8-methylphenanthrene-3,4-dione(r0-090680)

NA

C18H16O2 (264.115)


{"Ingredient_id": "HBIN005861","Ingredient_name": "2-isopropyl-8-methylphenanthrene-3,4-dione(r0-090680)","Alias": "NA","Ingredient_formula": "C18H16O2","Ingredient_Smile": "CC1=CC=CC2=C1C=CC3=C2C(=O)C(=O)C(=C3)C(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT16071","TCMID_id": "11626","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(4r)-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-2-one

(4r)-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-2-one

C11H20O7 (264.1209)


   

2-(4-methoxyphenyl)-5-[(1e)-prop-1-en-1-yl]-1-benzofuran

2-(4-methoxyphenyl)-5-[(1e)-prop-1-en-1-yl]-1-benzofuran

C18H16O2 (264.115)


   

4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-2-one

4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-2-one

C11H20O7 (264.1209)


   

2-isopropyl-8-methylphenanthrene-1,4-dione

2-isopropyl-8-methylphenanthrene-1,4-dione

C18H16O2 (264.115)


   

3-(2-hydroxyethyl)-4-[(3-hydroxypropyl)amino]-1h-indole-6,7-dione

3-(2-hydroxyethyl)-4-[(3-hydroxypropyl)amino]-1h-indole-6,7-dione

C13H16N2O4 (264.111)


   

2-(4-methoxyphenyl)-5-(prop-1-en-1-yl)-1-benzofuran

2-(4-methoxyphenyl)-5-(prop-1-en-1-yl)-1-benzofuran

C18H16O2 (264.115)


   

1-hydroxy-1-[(2z)-8-methylundec-2-en-6-yl]-1λ⁶-disulfen-1-one

1-hydroxy-1-[(2z)-8-methylundec-2-en-6-yl]-1λ⁶-disulfen-1-one

C12H24O2S2 (264.1218)


   

3-phenylprop-2-en-1-yl 3-phenylprop-2-enoate

3-phenylprop-2-en-1-yl 3-phenylprop-2-enoate

C18H16O2 (264.115)


   

1-hydroxy-1-[(2z,6r,8s)-8-methylundec-2-en-6-yl]-1λ⁶-disulfen-1-one

1-hydroxy-1-[(2z,6r,8s)-8-methylundec-2-en-6-yl]-1λ⁶-disulfen-1-one

C12H24O2S2 (264.1218)


   

hepta-4,6-diyn-1-yl undeca-2,4-dien-8,10-diynoate

hepta-4,6-diyn-1-yl undeca-2,4-dien-8,10-diynoate

C18H16O2 (264.115)


   

7-(hydroxymethyl)-1,3-dimethoxy-hexahydro-1h-cyclopenta[c]pyran-5,6,7-triol

7-(hydroxymethyl)-1,3-dimethoxy-hexahydro-1h-cyclopenta[c]pyran-5,6,7-triol

C11H20O7 (264.1209)


   

4-[3-methyl-5-(prop-1-en-1-yl)-1-benzofuran-2-yl]phenol

4-[3-methyl-5-(prop-1-en-1-yl)-1-benzofuran-2-yl]phenol

C18H16O2 (264.115)


   

8-ethenyl-1,7-dimethylphenanthrene-2,6-diol

8-ethenyl-1,7-dimethylphenanthrene-2,6-diol

C18H16O2 (264.115)


   

6-[(1e,3e,5e)-3-methyl-6-phenylhexa-1,3,5-trien-1-yl]pyran-2-one

6-[(1e,3e,5e)-3-methyl-6-phenylhexa-1,3,5-trien-1-yl]pyran-2-one

C18H16O2 (264.115)


   

(5z)-5-[(2e,4e,6e)-tetradeca-2,4,6-trien-8,10-diyn-1-ylidene]furan-2-one

(5z)-5-[(2e,4e,6e)-tetradeca-2,4,6-trien-8,10-diyn-1-ylidene]furan-2-one

C18H16O2 (264.115)


   

(2r,3r,4s,5s,6r)-2-{[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-{[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


   

n-[2-(methoxycarbonyl)phenyl]-2-methylbutanediimidic acid

n-[2-(methoxycarbonyl)phenyl]-2-methylbutanediimidic acid

C13H16N2O4 (264.111)


   

1-hydroxy-1-(8-methylundec-2-en-6-yl)-1λ⁶-disulfen-1-one

1-hydroxy-1-(8-methylundec-2-en-6-yl)-1λ⁶-disulfen-1-one

C12H24O2S2 (264.1218)


   

2-[(4-hydroxy-3-methylbut-2-en-1-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

2-[(4-hydroxy-3-methylbut-2-en-1-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


   

4-methoxy-5-(3-phenylprop-2-en-1-ylidene)-7ah-1-benzofuran

4-methoxy-5-(3-phenylprop-2-en-1-ylidene)-7ah-1-benzofuran

C18H16O2 (264.115)


   

4-(3-hydroxy-2-methyl-5-oxopyrrolidin-1-yl)-2-(2-methylprop-1-en-1-yl)-1,3-oxazin-6-one

4-(3-hydroxy-2-methyl-5-oxopyrrolidin-1-yl)-2-(2-methylprop-1-en-1-yl)-1,3-oxazin-6-one

C13H16N2O4 (264.111)


   

(2r,3r,4s,5s,6r)-2-{[(2z)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-{[(2z)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C11H20O7 (264.1209)


   

4-[3-methyl-5-(prop-2-en-1-yl)-1-benzofuran-2-yl]phenol

4-[3-methyl-5-(prop-2-en-1-yl)-1-benzofuran-2-yl]phenol

C18H16O2 (264.115)


   

5-phenyl-2-(phenylmethylidene)pent-4-enoic acid

5-phenyl-2-(phenylmethylidene)pent-4-enoic acid

C18H16O2 (264.115)


   

hepta-4,6-diyn-1-yl (2e,4e)-undeca-2,4-dien-8,10-diynoate

hepta-4,6-diyn-1-yl (2e,4e)-undeca-2,4-dien-8,10-diynoate

C18H16O2 (264.115)


   

n-{1-[4-(2-cyanoethoxy)phenyl]-1,3-dihydroxypropan-2-yl}carboximidic acid

n-{1-[4-(2-cyanoethoxy)phenyl]-1,3-dihydroxypropan-2-yl}carboximidic acid

C13H16N2O4 (264.111)


   

2-isopropyl-8-methylphenanthrene-3,4-dione

2-isopropyl-8-methylphenanthrene-3,4-dione

C18H16O2 (264.115)


   

4-[(2s,3s)-3-hydroxy-2-methyl-5-oxopyrrolidin-1-yl]-2-(2-methylprop-1-en-1-yl)-1,3-oxazin-6-one

4-[(2s,3s)-3-hydroxy-2-methyl-5-oxopyrrolidin-1-yl]-2-(2-methylprop-1-en-1-yl)-1,3-oxazin-6-one

C13H16N2O4 (264.111)