Exact Mass: 228.0336
Exact Mass Matches: 228.0336
Found 500 metabolites which its exact mass value is equals to given mass value 228.0336,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
MCPB
D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals CONFIDENCE standard compound; EAWAG_UCHEM_ID 2710 CONFIDENCE standard compound; INTERNAL_ID 578; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5034; ORIGINAL_PRECURSOR_SCAN_NO 5030 CONFIDENCE standard compound; INTERNAL_ID 578; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4996; ORIGINAL_PRECURSOR_SCAN_NO 4991 CONFIDENCE standard compound; INTERNAL_ID 578; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5038; ORIGINAL_PRECURSOR_SCAN_NO 5036 CONFIDENCE standard compound; INTERNAL_ID 578; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5019; ORIGINAL_PRECURSOR_SCAN_NO 5018 CONFIDENCE standard compound; INTERNAL_ID 578; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5021; ORIGINAL_PRECURSOR_SCAN_NO 5016 CONFIDENCE standard compound; INTERNAL_ID 578; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5033; ORIGINAL_PRECURSOR_SCAN_NO 5031
Mevalonic acid-5P
Mevalonic acid-5p, also known as (R)-5-phosphomevalonate or mevalonate-5p, is a member of the class of compounds known as monoalkyl phosphates. Monoalkyl phosphates are organic compounds containing a phosphate group that is linked to exactly one alkyl chain. Thus, mevalonic acid-5p is considered to be a fatty acid lipid molecule. Mevalonic acid-5p is soluble (in water) and a moderately acidic compound (based on its pKa). Mevalonic acid-5p can be found in a number of food items such as rowanberry, common oregano, caraway, and cherry tomato, which makes mevalonic acid-5p a potential biomarker for the consumption of these food products. Mevalonic acid-5p can be found primarily throughout most human tissues. Mevalonic acid-5p exists in all eukaryotes, ranging from yeast to humans. In humans, mevalonic acid-5p is involved in several metabolic pathways, some of which include pamidronate action pathway, rosuvastatin action pathway, pravastatin action pathway, and lovastatin action pathway. Mevalonic acid-5p is also involved in several metabolic disorders, some of which include hypercholesterolemia, lysosomal acid lipase deficiency (wolman disease), hyper-igd syndrome, and mevalonic aciduria. Mevalonic acid-5P (CAS: 1189-94-2), also known as 5-phosphomevalonic acid, belongs to the class of organic compounds known as monoalkyl phosphates. These are organic compounds containing a phosphate group that is linked to exactly one alkyl chain. Within humans, mevalonic acid-5P participates in many enzymatic reactions. In particular, mevalonic acid-5P can be biosynthesized from mevalonate; which is mediated by the enzyme mevalonate kinase. In addition, mevalonic acid-5P can be converted into mevalonic acid-5-pyrophosphate through its interaction with the enzyme phosphomevalonate kinase. In humans, mevalonic acid-5P is involved in the mevalonate pathway. Outside of the human body, mevalonic acid-5P has been detected, but not quantified in, several different foods, such as oriental wheat, devilfish, pepper (spice), redcurrants, and star fruits. This could make mevalonic acid-5P a potential biomarker for the consumption of these foods.
L-2-Aminoethyl seryl phosphate
L-2-Aminoethyl seryl phosphate is found in animal foods. L-2-Aminoethyl seryl phosphate is isolated from numerous animals including chicken, fish and reptile Isolated from numerous animals including chicken, fish and reptiles. L-2-Aminoethyl seryl phosphate is found in fishes and animal foods.
2-Hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate
Euxanthone
Occurs in Mammea americana (mamey), Platonia insignis (bakuri) and Mangifera indica (mango). Euxanthone is found in fruits and mammee apple. Euxanthone is found in fruits. Euxanthone occurs in Mammea americana (mamey), Platonia insignis (bakuri) and Mangifera indica (mango
[(2R,3R,4R)-3,4-dihydroxy-5-oxooxolan-2-yl]methyl dihydrogen phosphate
[(2S,3R,4R)-3,4-dihydroxy-5-oxooxolan-2-yl]methyl dihydrogen phosphate
Urolithin A
Urolithin A is a secondary metabolite of ellagic acid which may be glucuronidated by liver enzymes during phase II metabolism. A polyphenol metabolite detected in biological fluids [PhenolExplorer] Urolithin A, a gut-microbial metabolite of ellagic acid, exerts anti-inflammatory, antiproliferative, and antioxidant properties. Urolithin A induces autophagy and apoptosis, suppresses cell cycle progression, and inhibits DNA synthesis[1][2]. Urolithin A, a gut-microbial metabolite of ellagic acid, exerts anti-inflammatory, antiproliferative, and antioxidant properties. Urolithin A induces autophagy and apoptosis, suppresses cell cycle progression, and inhibits DNA synthesis[1][2].
5-Ethynyl-5'-(1-propynyl)-2,2'-bithiophene
5-Ethynyl-5-(1-propynyl)-2,2-bithiophene is isolated from Tagetes erecta (African marigold
1,5-Dihydroxyxanthone
1,5-Dihydroxyxanthone is found in fruits. 1,5-Dihydroxyxanthone is a constituent of Garcinia species, Mammea americana (mamey) Constituent of Garcinia subspecies, Mammea americana (mamey). 1,5-Dihydroxyxanthone is found in fruits and mammee apple.
2,3,5,6-Tetramethylpyrazine phosphate
Aminoethylcysteine ketimine decarboxylated dimer
alpha-D-xylose 1-phosphate
beta-l-arabinose 1-phosphate is soluble (in water) and a moderately acidic compound (based on its pKa). beta-l-arabinose 1-phosphate can be found in a number of food items such as climbing bean, rubus (blackberry, raspberry), loganberry, and garland chrysanthemum, which makes beta-l-arabinose 1-phosphate a potential biomarker for the consumption of these food products.
1-(5-propynyl-2-thienyl)-2-(2-thienyl)acetylene|2(1-Propynyl)-5-(2-thienylethynyl)thiophene|2--5--thiophen|2--5--thiophene|2-propynyl-5-<(2-thienyl)ethynyl>thiophene|5-prop-1-ynyl-2,2-ethynediyl-bis-thiophene
4-chloro-6,8-dihydroxy-3-methylisochroman-1-one|4-chloro-6-hydroxymellein
3, 4-Dihydro-7-Chloro-6, 8-dihydroxy-3-methyl-1H-2-benzopyran-1-one
2-methylimidazo[1,5-b]isoquinoline-1,3,5(2H)-trione
7-chloro-3,4-dihydro-4,8-dihydroxy-3-methyl-1H-2-benzopyran-1-one|7-chloromellein-5-ol
(3R)-7-chloro-3,6,8-trihydroxy-3,4-dihydronaphthalen-1(2H)-one|7-chloroscytalone
2-Methyl-9-Chloro-p-mentha-1,3,5,8-tetraene-2,5,10-triol|Z-3-chloro-2-(2-hydroxy-4-methyl-5-methoxyphenyl)-prop-2-en-1-ol
((2S)-4-butyryl-3,5-dioxo-tetrahydro-[2]furyl)-acetic acid|((2S)-4-Butyryl-3,5-dioxo-tetrahydro-[2]furyl)-essigsaeure
Di-Me ester-3-Hydroxy-4-oxo-4H-pyran-2,6-dicarboxylic acid
Euxanthone
Euxanthone is a member of the class of xanthones that is 9H-xanthene substituted by hydroxy group at positions 1 and 7 and an oxo group at position 9. It has been isolated from Cratoxylum cochinchinense. It has a role as a plant metabolite and a metabolite. It is a member of xanthones and a member of phenols. Euxanthone is a natural product found in Garcinia oblongifolia, Hypericum scabrum, and other organisms with data available. A member of the class of xanthones that is 9H-xanthene substituted by hydroxy group at positions 1 and 7 and an oxo group at position 9. It has been isolated from Cratoxylum cochinchinense. Occurs in Mammea americana (mamey), Platonia insignis (bakuri) and Mangifera indica (mango). Euxanthone is found in fruits and mammee apple. Euxanthone is found in fruits. Euxanthone occurs in Mammea americana (mamey), Platonia insignis (bakuri) and Mangifera indica (mango
urolithin A
Urolithin A, a gut-microbial metabolite of ellagic acid, exerts anti-inflammatory, antiproliferative, and antioxidant properties. Urolithin A induces autophagy and apoptosis, suppresses cell cycle progression, and inhibits DNA synthesis[1][2]. Urolithin A, a gut-microbial metabolite of ellagic acid, exerts anti-inflammatory, antiproliferative, and antioxidant properties. Urolithin A induces autophagy and apoptosis, suppresses cell cycle progression, and inhibits DNA synthesis[1][2].
Sulfamide, (1,3-dihydro-3-oxo-1-isobenzofuranyl)- (9CI)
Imidazo[2,1-b]thiazole-5-carboxaldehyde, 6-phenyl-
4-(2-(Methacryloyloxy)ethoxy)-4-oxobut-2-enoic acid
1,4-DICHLORO-5,6,7,8-TETRAHYDRO-5,8-ETHANOPHTHALAZINE
ethyl 2-amino-5-carbamoyl-4-methylthiophene-3-carboxylate
2,2-DIFLUORO-3-OXO-3-PHENYL-PROPIONIC ACID ETHYL ESTER
4-Methyl-2-morpholin-4-yl-thiazole-5-carboxylic acid
1-METHANESULFINYL-4-METHYLSULFANYL-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIDAZINE
2-(1H-1,2,4-Triazol-1-yl)-5-(trifluoromethyl)aniline
2-(hydroxyimino)-1-((4-methylphenyl)sulfonyl)eth-2-ylamine
(2-CHLORO-6-FLUORO-4-(TRIFLUOROMETHYL)PHENYL)HYDRAZINE
Anpirtoline
C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
(5-(TERT-BUTOXYCARBONYL)THIOPHEN-2-YL)BORONIC ACID
CARBONIC ACID 4-CHLOROMETHYL-3-METHYL-PHENYL ESTER ETHYL ESTER
(4-(Trifluoromethoxy)phenyl)hydrazine hydrochloride
ETHYL 4-METHYL-2-(METHYLTHIO)-6-OXO-1,6-DIHYDROPYRIMIDINE-5-CARBOXYLATE
potassium,trifluoro-[2-(2-hydroxyethyl)phenyl]boranuide
potassium,trifluoro-[4-(2-hydroxyethyl)phenyl]boranuide
potassium (4-methoxy-2-methylphenyl)trifluoroborate
4H-1,3-Benzodioxin-6-carboxylic acid, 8-(chloromethyl)-
2-HYDROXYMETHYL-1 H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID HYDROCHLORIDE
3,3,3-trifluoro-(2-tetrahydrothienylmethyl)propionic acid
7-METHOXY-1,1-DIOXO-1,4-DIHYDRO-2H-1LAMBDA6-BENZO[1,2,4]THIADIAZIN-3-ONE
N-(2-HYDROXYETHYL)AMMONIUM BENZO-THIAZOLE-2-THIOLATE
7-Difluoromethyl-5-methyl-[1,2,4]triazolo-[1,5-a]pyrimidine-2-carboxylic acid
(2-Isopropylthiazol-4-yl)methanamine dihydrochloride
4-CHLORO-1-ETHYL-6-(METHYLTHIO)-1H-PYRAZOLO[3,4-D]PYRIMIDINE
3-(5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid
5-(4-(Trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-amine
4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylic acid
Acetic acid,2-(4-chloro-2-methylphenoxy)-, ethyl ester
5H-Tetrazole-5-thione,1,2-dihydro-1-(1-naphthalenyl)-
3-(3-Furyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
5-(3-(Trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-amine
N-(5-chloro-pyridin-2-yl)-oxalamic acid ethyl ester
(7-BROMO-2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)(PHENYL)METHANONE
4-(Trifluoromethyl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one
3-(Difluoromethyl)-4-hydroxy-1H-pyrrolo[2,3-b]pyridine-2-carboxyl ic acid
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride
4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentan-1-ol
1-methyl-5-nitro-1,3-dihydrobenzo[c]isothiazole 2,2-dioxide
1-(2,2,2-TRIFLUOROETHYL)-3-(TRIFLUOROMETHYL)BENZENE
2,4-Diamino-6-(hydroxymethyl)pteridine hydrochloride
2,3-Dihydro-5-methyl-4-[(2-methyl-3-furanyl)dithio]furan
METHYL 2-[[(2-CHLORO-3-PYRIDYL)CARBONYL]AMINO]ACETATE
2-Propanone,3-(1H-benzimidazol-2-yl)-1,1,1-trifluoro-
5-Pyrimidineaceticacid, 3,4-dihydro-2-(methylthio)-4-oxo-, ethyl ester
3-[2,2-DIFLUOROBENZO[1,3]-DIOXOL-5-YL]ACRYLIC ACID
4-Methoxy-2-morpholin-4-yl-thiazole-5-carbaldehyde
Methyl 5-(3-cyanophenyl)-1,2-oxazole-3-carboxylate
Triazavirin
COVID info from DrugBank, clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Carlosic acid
A tetronic acid derivative that is furan-2(5H)-one which is substituted at positions 3, 4, and 5 by butanoyl, hydroxy, and carboxymethyl groups, respectively (the S enantiomer).
2-(butylthio)-4-oxo-1H-pyrimidine-6-carboxylic acid
1,2,3,4,7,7-Hexafluoro-5-vinylbicyclo[2.2.1]hept-2-ene
8-Hydroxy-2-oxa-bicyclo[3.3.1]non-6-ene-3,5-dicarboxylic acid
alpha-D-xylose 1-phosphate
beta-l-arabinose 1-phosphate is soluble (in water) and a moderately acidic compound (based on its pKa). beta-l-arabinose 1-phosphate can be found in a number of food items such as climbing bean, rubus (blackberry, raspberry), loganberry, and garland chrysanthemum, which makes beta-l-arabinose 1-phosphate a potential biomarker for the consumption of these food products. β-l-arabinose 1-phosphate is soluble (in water) and a moderately acidic compound (based on its pKa). β-l-arabinose 1-phosphate can be found in a number of food items such as climbing bean, rubus (blackberry, raspberry), loganberry, and garland chrysanthemum, which makes β-l-arabinose 1-phosphate a potential biomarker for the consumption of these food products.
alpha-D-Ribofuranose 1-phosphate
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
5-phospho-beta-D-ribosylaminium(1-)
Conjugate base of 5-phospho-beta-D-ribosylamine. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
(2E,4Z,7S)-7-ammonio-5-formyl-2-hydroxyocta-2,4-dienedioate
[(2R,3S,4R,5S)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate
(E,2S)-2-azaniumyl-7-hydroxy-4-[(E)-2-oxidoethenyl]-6,7-dioxohept-4-enoate
(E)-2-hydroxy-3-[(E)-4-methyl-3-oxopent-1-enyl]but-2-enedioic acid
(2R)-2-amino-3-[2-aminoethoxy(hydroxy)phosphoryl]oxypropanoic acid
[(2R,3S,4R)-2,3,4-trihydroxy-5-oxopentyl] dihydrogen phosphate
[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl] phosphate
(1S,4R)-1-(2-carboxy-2-oxoethyl)-4-hydroxycyclohex-2-ene-1-carboxylic acid
6-(2,4-Dichlorophenyl)-1,5-diazabicyclo[3.1.0]hexane
3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester
8-Hydroxy-2-oxabicyclo[3.3.1]non-6-ene-3,5-dicarboxylic acid
(2E,4Z,6S)-6-ammonio-2-hydroxy-4-(2-oxoethylidene)hept-2-enedioate
4-chloro-N-[(Z)-1-hydrazinyl-2-nitroethenyl]aniline
(Z)-3-(dihydroxymethylidene)-7-methyl-2,6-dioxooct-4-enoic acid
2-Oxo-3-(2,3,4,5-tetrahydroxyphenyl)propanoic acid
2-(2,3,5-Trihydroxy-4-methoxyphenyl)propanoic acid
(3R)-3-Hydroxy-3-methyl-5-(phosphonooxy)pentanoic acid
(3r)-5-Hydroxy-3-Methyl-3-(Phosphonooxy)pentanoic Acid
D-xylulose 5-phosphate(2-)
An organophosphate oxoanion that is the dianion of D-xylulose 5-phosphate arising from deprotonation of the phosphate OH groups; major species at pH 7.3.
D-ribulose 5-phosphate(2-)
An organophosphate oxoanion that is the dianion resulting from the removal of two protons from the phosphate group of D-ribulose 5-phosphate.
Serine phosphoethanolamine
The O-phosphoethanolamine derivative of serine.
2-Ammonio-3-{[(2-ammonioethoxy)phosphinato]oxy}propanoate
L-serine phosphoethanolamine dizwitterion
Zwitterionic form of L-serine phosphoethanolamine having anionic phosphate and carboxy groups and both amino groups protonated; major species at pH 7.3.
(R)-5-Phosphomevalonic acid
A carboxyalkyl phosphate that is mevalonic acid phosphorylated at position 5.
serine phosphoethanolamine dizwitterion
Dizwitterionic form of serine phosphoethanolamine having anionic carboxy and phosphate groups and both amino groups protonated.
4-chloro-2-(hepta-1,3,5-triyn-1-yl)-1-methoxybenzene
6-hydroxy-3-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyran-2-one
(3r)-7-chloro-5,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
5-hydroxy-3-methylnaphtho[2,3-c]furan-4(9h)-one,9ci; 9-oxo
{"Ingredient_id": "HBIN011608","Ingredient_name": "5-hydroxy-3-methylnaphtho[2,3-c]furan-4(9h)-one,9ci; 9-oxo","Alias": "NA","Ingredient_formula": "C13H8O4","Ingredient_Smile": "NA","Ingredient_weight": "228.2","OB_score": "NA","CAS_id": "159539-24-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7670","PubChem_id": "NA","DrugBank_id": "NA"}
(5r,8r)-1,6,9,13-tetraoxadispiro[4.2.4.2]-tetradecane-2,10-dione
{"Ingredient_id": "HBIN011913","Ingredient_name": "(5r,8r)-1,6,9,13-tetraoxadispiro[4.2.4.2]-tetradecane-2,10-dione","Alias": "NA","Ingredient_formula": "C10H12O6","Ingredient_Smile": "C1CC2(COC3(CCC(=O)O3)CO2)OC1=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21193","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
