Exact Mass: 228.0273126
Exact Mass Matches: 228.0273126
Found 500 metabolites which its exact mass value is equals to given mass value 228.0273126,
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
3,5-Dinitrosalicylic acid
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates KEIO_ID D050
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.
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
Thiolutin
Thiolutin is found in alcoholic beverages. Thiolutin is isolated from several strains of Streptomyces albus and Streptomyces pimprina. Antibiotic which inhibits microbiological growth in beer Some sources erroneously specify "aureothricin" as a synonym of thiolutin. Aureothricin is an antibiotic very similar to Thiolutin, and is created as a by-product during the Thiolutin fermentation. Thiolutin is a sulfur-containing antibiotic, which is a potent inhibitor of bacterial and yeast RNA polymerases. It was found to inhibit in vitro RNA synthesis directed by all three yeast RNA polymerases (I, II, and III). Thiolutin is also an inhibitor of mannan and glucan formation in Saccharomyces cerevisiae and used for the analysis of mRNA stability. Studies have shown that thiolutin inhibits adhesion of human umbilical vein endothelial cells (HUVECs) to vitronectin and thus suppresses tumor cell-induced angiogenesis in vivo Isolated from several strains of Streptomyces albus and Streptomyces pimprina. Antibiotic which inhibits microbiological growth in beer C471 - Enzyme Inhibitor > C25995 - RNA Polymerase Inhibitor C254 - Anti-Infective Agent > C258 - Antibiotic Thiolutin (Acetopyrrothin) is a disulfide-containing antibiotic and anti-angiogenic compound produced by Streptomyces. Thiolutin inhibits the JAMM metalloproteases Csn5, Associated-molecule-with-the-SH3-Domain-of-STAM (AMSH) and Brcc36[1]. Thiolutin is a potent and selective inhibitor of endothelial cell adhesion accompanied by rapid induction of Heat-shock protein beta-1 (Hsp27) phosphorylation[2].
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
C9H12N2OS2 (228.03910219999997)
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.
2-thiophen-2-yl-1H-quinazolin-4-one
C12H8N2OS (228.03573179999998)
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
C10H9ClO4 (228.01893439999998)
3, 4-Dihydro-7-Chloro-6, 8-dihydroxy-3-methyl-1H-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
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
C10H9ClO4 (228.01893439999998)
(3R)-7-chloro-3,6,8-trihydroxy-3,4-dihydronaphthalen-1(2H)-one|7-chloroscytalone
C10H9ClO4 (228.01893439999998)
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
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
Thiolutin
A dithiolopyrrolone antibiotic that is 4,5-dihydro[1,2]dithiolo[4,3-b]pyrrole in which the hydrogens at positions 4,5 and 6 have been replaced by methyl, oxo and acetamido groups, respectively. It is a potent inhibitor of RNA polymerases, inhibits the angiogenesis of human umbilical vein endothelial cells, and also inhibits JAMM metalloproteases. C471 - Enzyme Inhibitor > C25995 - RNA Polymerase Inhibitor C254 - Anti-Infective Agent > C258 - Antibiotic Thiolutin (Acetopyrrothin) is a disulfide-containing antibiotic and anti-angiogenic compound produced by Streptomyces. Thiolutin inhibits the JAMM metalloproteases Csn5, Associated-molecule-with-the-SH3-Domain-of-STAM (AMSH) and Brcc36[1]. Thiolutin is a potent and selective inhibitor of endothelial cell adhesion accompanied by rapid induction of Heat-shock protein beta-1 (Hsp27) phosphorylation[2].
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].
5-Chloro-3-phenyl-1H-pyrrolo[2,3-b]pyridine
C13H9ClN2 (228.04542239999998)
Sulfamide, (1,3-dihydro-3-oxo-1-isobenzofuranyl)- (9CI)
C8H8N2O4S (228.02047679999998)
1-bromo-4-(2-methoxypropan-2-yl)benzene
C10H13BrO (228.01497080000001)
3-(Trifluoromethoxy)phenylhydrazine hydrochloride
C7H8ClF3N2O (228.02772239999996)
Butanedioic acid,2-(2-chlorophenyl)-
C10H9ClO4 (228.01893439999998)
Imidazo[2,1-b]thiazole-5-carboxaldehyde, 6-phenyl-
C12H8N2OS (228.03573179999998)
methyl 4-(methylsulfonylmethyl)benzoate
C10H12O4S (228.04562719999998)
potassium (4-carboxyphenyl)trifluoroborate
C7H5BF3KO2 (227.99717560000002)
4-Chloro-5-nitro-6-(1-pyrrolidinyl)pyrimidine
C8H9ClN4O2 (228.04140040000001)
2-Carbethoxy-3-(2-thienyl)propionic acid
C10H12O4S (228.04562719999998)
Phenol,4-bromo-2-(1,1-dimethylethyl)-
C10H13BrO (228.01497080000001)
1-(4-bromophenyl)-2-methyl-propan-2-ol
C10H13BrO (228.01497080000001)
1-(3-chloro-4-fluorophenyl)pyrazolidine-3,5-dione
C9H6ClFN2O2 (228.01018180000003)
1-(2-bromopropyl)-3-methoxybenzene
C10H13BrO (228.01497080000001)
1-(3-Bromopropyl)-2-methoxybenzene
C10H13BrO (228.01497080000001)
1,4-DICHLORO-5,6,7,8-TETRAHYDRO-5,8-ETHANOPHTHALAZINE
C10H10Cl2N2 (228.02210000000002)
Ethyl 4-(methylsulfonyl)benzoate
C10H12O4S (228.04562719999998)
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
N-(2-cyanophenyl)thiophene-2-carboxamide
C12H8N2OS (228.03573179999998)
(2-(4-fluorophenyl)oxazol-4-yl)methanamine HCl
C10H10ClFN2O (228.04656519999997)
1-METHANESULFINYL-4-METHYLSULFANYL-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIDAZINE
C9H12N2OS2 (228.03910219999997)
2-(hydroxyimino)-1-((4-methylphenyl)sulfonyl)eth-2-ylamine
METHYL 3-(METHYLSULFONYL)PHENYLACETATE
C10H12O4S (228.04562719999998)
(2-CHLORO-6-FLUORO-4-(TRIFLUOROMETHYL)PHENYL)HYDRAZINE
Anpirtoline
C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
5-Chloro-2-phenyl-imidazo[1,2-a]pyridine
C13H9ClN2 (228.04542239999998)
CARBONIC ACID 4-CHLOROMETHYL-3-METHYL-PHENYL ESTER ETHYL ESTER
(4-(Trifluoromethoxy)phenyl)hydrazine hydrochloride
C7H8ClF3N2O (228.02772239999996)
2-phenylthieno[2,3-d]pyrimidin-4-ol
C12H8N2OS (228.03573179999998)
DIMETHYL 2-(THIOPHEN-2-YLMETHYL)MALONATE
C10H12O4S (228.04562719999998)
Dichlorobis(trimethylsilyl)methane
C7H18Cl2Si2 (228.03240480000002)
2-(3,4-dimethoxyphenylthio)acetic acid
C10H12O4S (228.04562719999998)
6-chloro-2-phenylimidazo[1,2-a]pyridine
C13H9ClN2 (228.04542239999998)
POTASSIUM ((BENZYLOXY)METHYL)TRIFLUOROBORATE
C8H9BF3KO (228.03355899999997)
3-[4-(METHYLSULFONYL)PHENYL]PROPANOIC ACID
C10H12O4S (228.04562719999998)
ETHYL 4-METHYL-2-(METHYLTHIO)-6-OXO-1,6-DIHYDROPYRIMIDINE-5-CARBOXYLATE
2-Chloro-4-(ethoxycarbonyl)benzoic acid
C10H9ClO4 (228.01893439999998)
potassium,trifluoro-[2-(2-hydroxyethyl)phenyl]boranuide
C8H9BF3KO (228.03355899999997)
potassium,trifluoro-[4-(2-hydroxyethyl)phenyl]boranuide
C8H9BF3KO (228.03355899999997)
5-Phenylthieno[2,3-d]pyrimidin-4(3H)-one
C12H8N2OS (228.03573179999998)
1,3-Bis(chlorodimethylsilyl)propane
C7H18Cl2Si2 (228.03240480000002)
1-(4-(2,2-DICHLOROCYCLOPROPYL)PHENYL)ETHANONE
C11H10Cl2O (228.01086700000002)
potassium (4-methoxy-2-methylphenyl)trifluoroborate
C8H9BF3KO (228.03355899999997)
4H-1,3-Benzodioxin-6-carboxylic acid, 8-(chloromethyl)-
C10H9ClO4 (228.01893439999998)
6-(Difluoromethoxy)-1H-indazole-3-carboxylic acid
C9H6F2N2O3 (228.03464699999998)
3-(4-Chlorophenyl)-imidazo[1,2-a]pyridine
C13H9ClN2 (228.04542239999998)
7-chloro-2-phenyl-1H-pyrrolo[3,2-b]pyridine
C13H9ClN2 (228.04542239999998)
3-oxopropyl 4-methylbenzenesulfonate
C10H12O4S (228.04562719999998)
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
C8H8N2O4S (228.02047679999998)
potassium 3-carboxyphenyltrifluoroborat&
C7H5BF3KO2 (227.99717560000002)
N-(2-HYDROXYETHYL)AMMONIUM BENZO-THIAZOLE-2-THIOLATE
C9H12N2OS2 (228.03910219999997)
7-Difluoromethyl-5-methyl-[1,2,4]triazolo-[1,5-a]pyrimidine-2-carboxylic acid
C8H6F2N4O2 (228.04587999999998)
1-(4-CHLORO-BENZOYLAMINO)-CYCLOPENTANECARBOXYLICACID
(2-Isopropylthiazol-4-yl)methanamine dihydrochloride
4-CHLORO-1-ETHYL-6-(METHYLTHIO)-1H-PYRAZOLO[3,4-D]PYRIMIDINE
methyl 3-chlorocarbonyl-4-methoxy-benzoate
C10H9ClO4 (228.01893439999998)
2-(4-bromophenyl)-2-Methylpropan-1-ol
C10H13BrO (228.01497080000001)
5-(Difluoromethoxy)-1H-indazole-3-carboxylic acid
C9H6F2N2O3 (228.03464699999998)
Methyl 3-Methyl-4-(methylsulfonyl)benzoate
C10H12O4S (228.04562719999998)
2-(3-Bromophenyl)-2-Methylpropan-1-ol
C10H13BrO (228.01497080000001)
Methyl 3-amino-4-cyano-5-(methylthio)thiophene-2-carboxylate
3-AMINO-4-CHLORO-BENZENEMETHANAMINE DIHYDROCHLORIDE
3-(5-oxo-1-prop-2-enyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid
1-(2-Bromoethoxy)-2,4-dichlorobenzene
C10H13BrO (228.01497080000001)
3-CHLORO-2-FLUORO-5-(TRIFLUOROMETHYL)BENZYLALCOHOL
(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one
C9H12N2OS2 (228.03910219999997)
[4-(Ethylsulfonyl)phenyl]acetic acid
C10H12O4S (228.04562719999998)
4-oxo-3,5-dihydropyrrolo[2,3-c]quinoline-1-carboxylic acid
3-Oxetanyl 4-methylbenzenesulfonate
C10H12O4S (228.04562719999998)
Acetic acid,2-(4-chloro-2-methylphenoxy)-, ethyl ester
5H-Tetrazole-5-thione,1,2-dihydro-1-(1-naphthalenyl)-
Benzene,1-(3-bromopropoxy)-3-methyl-
C10H13BrO (228.01497080000001)
4-BROMO-5-ISOPROPYL-2-METHYLBENZENOL
C10H13BrO (228.01497080000001)
3-(TOLUENE-4-SULFONYL)-PROPIONIC ACID
C10H12O4S (228.04562719999998)
2-(Trifluoromethoxy)phenylhydrazine hydrochloride
C7H8ClF3N2O (228.02772239999996)
Methyl 2-Methyl-4-(methylsulfonyl)benzoate
C10H12O4S (228.04562719999998)
Acetoxy(4-chlorophenyl)acetic acid
C10H9ClO4 (228.01893439999998)
3-(3-Furyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid
2-methoxy-5-[(E)-prop-1-enyl]benzenesulfonic acid
C10H12O4S (228.04562719999998)
N-(5-chloro-pyridin-2-yl)-oxalamic acid ethyl ester
(7-BROMO-2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)(PHENYL)METHANONE
1-(3-Bromopropoxy)-2-methylbenzene
C10H13BrO (228.01497080000001)
methyl 2-(4-methylphenyl)sulfonylacetate
C10H12O4S (228.04562719999998)
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
C9H6F2N2O3 (228.03464699999998)
METHYL 2-(4-(METHYLSULFONYL)PHENYL)ACETATE
C10H12O4S (228.04562719999998)
4-(2-Bromoethyl)-1-methoxy-2-methylbenzene
C10H13BrO (228.01497080000001)
CYCLOBUTANECARBONYL CHLORIDE,1-(4-CHLOROPHENYL)-
C11H10Cl2O (228.01086700000002)
6-PHENYL-3,4-DIHYDROTHIENO[3,2-D]PYRIMIDIN-4-ONE
C12H8N2OS (228.03573179999998)
POTASSIUM 3,4-(METHYLENEDIOXY)PHENYLTRI&
C7H5BF3KO2 (227.99717560000002)
2-Isopropyl-4-bromo-5-methylphenol
C10H13BrO (228.01497080000001)
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride
C6H8ClF3N4 (228.03895539999996)
1-ethyl-2-methyl-5,6-dichlorobenzimidazole
C10H10Cl2N2 (228.02210000000002)
Ethyl2-(2-formamidothiazol-4-yl)-2-oxoacetate
C8H8N2O4S (228.02047679999998)
6-PHENOXY-3-PYRIDINYL ISOTHIOCYANATE
C12H8N2OS (228.03573179999998)
4,5,5,5-tetrafluoro-4-(trifluoromethyl)pentan-1-ol
1-methyl-5-nitro-1,3-dihydrobenzo[c]isothiazole 2,2-dioxide
C8H8N2O4S (228.02047679999998)
4-Methoxy-2-(methylsulphonyl)acetophenone
C10H12O4S (228.04562719999998)
2-(6-CHLORO-2-PYRIDINYL)-2-PHENYLACETONITRILE
C13H9ClN2 (228.04542239999998)
1-(2,2,2-TRIFLUOROETHYL)-3-(TRIFLUOROMETHYL)BENZENE
2-(2-Bromo-ethoxy)-1,3-dimethyl-benzene
C10H13BrO (228.01497080000001)
2-(2-bromoethoxy)-1,4-dimethylbenzene
C10H13BrO (228.01497080000001)
1-(3-Bromopropyl)-4-methoxybenzene
C10H13BrO (228.01497080000001)
2,4-Diamino-6-(hydroxymethyl)pteridine hydrochloride
3-PHENYLMETHANESULFONYL-PROPIONIC ACID
C10H12O4S (228.04562719999998)
5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine
C13H9ClN2 (228.04542239999998)
2,3-Dihydro-5-methyl-4-[(2-methyl-3-furanyl)dithio]furan
METHYL 2-[[(2-CHLORO-3-PYRIDYL)CARBONYL]AMINO]ACETATE
Potassium (4-ethoxyphenyl)trifluoroborate
C8H9BF3KO (228.03355899999997)
2-Propanone,3-(1H-benzimidazol-2-yl)-1,1,1-trifluoro-
2-(4-Chlorophenyl)-2-(pyridin-2-yl)acetonitrile
C13H9ClN2 (228.04542239999998)
5-Pyrimidineaceticacid, 3,4-dihydro-2-(methylthio)-4-oxo-, ethyl ester
3-[2,2-DIFLUOROBENZO[1,3]-DIOXOL-5-YL]ACRYLIC ACID
C10H6F2O4 (228.02341399999997)
4-Methoxy-2-morpholin-4-yl-thiazole-5-carbaldehyde
2-(3-nitropyridin-2-yl)sulfanylpropanoic Acid
C8H8N2O4S (228.02047679999998)
Methyl 5-(3-cyanophenyl)-1,2-oxazole-3-carboxylate
2-PHENYLTHIENO[3,2-D]PYRIMIDIN-4-OL
C12H8N2OS (228.03573179999998)
POTASSIUMTRIFLUORO(4-METHOXYBENZYL)BORATE
C8H9BF3KO (228.03355899999997)
POTASSIUM 3-(2-HYDROXYETHYL)PHENYLTRIFLUOROBORATE
C8H9BF3KO (228.03355899999997)
1-(bromomethyl)-2-propan-2-yloxybenzene
C10H13BrO (228.01497080000001)
Triazavirin
C5H4N6O3S (228.00655940000001)
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
2-(butylthio)-4-oxo-1H-pyrimidine-6-carboxylic acid
3-Methanesulfonyl-benzoic acid ethyl ester
C10H12O4S (228.04562719999998)
1,2,3,4,7,7-Hexafluoro-5-vinylbicyclo[2.2.1]hept-2-ene
N-oxo-2-(phenylsulfonylamino)ethanamide
C8H8N2O4S (228.02047679999998)
S-[2-(Aminosulfonyl)ethyl]-D-Cysteine
C5H12N2O4S2 (228.02384719999998)
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
(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
6-(2,4-Dichlorophenyl)-1,5-diazabicyclo[3.1.0]hexane
C10H10Cl2N2 (228.02210000000002)
3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid methyl ester
(2E,4Z,6S)-6-ammonio-2-hydroxy-4-(2-oxoethylidene)hept-2-enedioate
4-chloro-N-[(Z)-1-hydrazinyl-2-nitroethenyl]aniline
C8H9ClN4O2 (228.04140040000001)
2-Oxo-3-(2,3,4,5-tetrahydroxyphenyl)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.
aldehydo-D-ribose 5-phosphate(2-)
An organophosphate oxoanion arising from deprotonation of the phosphate OH groups of aldehydo-D-ribose 5-phosphate; major species at pH 7.3.
aldehydo-D-arabinose 5-phosphate(2-)
An organophosphate oxoanion that is the dianion of D-arabinose 5-phosphate arising from deprotonation of both phosphate OH groups; major species at pH 7.3.
alpha-D-ribose 1-phosphate(2-)
Dianion of alpha-D-ribose 1-phosphate arising from deprotonation of both phosphate OH groups; major species at pH 7.3.
Serine phosphoethanolamine
The O-phosphoethanolamine derivative of serine.
D-arabinofuranose 5-phosphate(2-)
An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of D-arabinofuranose-5-phosphate; major species at pH 7.3.
2-Ammonio-3-{[(2-ammonioethoxy)phosphinato]oxy}propanoate
3,5-DINITROSALICYLIC ACID
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
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.
L-xylulose 5-phosphate(2-)
An organophosphate oxoanion that is the dianion of L-xylulose 5-phosphate arising from deprotonation of the phosphate OH groups; major species at pH 7.3.
(R)-5-Phosphomevalonic acid
A carboxyalkyl phosphate that is mevalonic acid phosphorylated at position 5.
L-ribulose 5-phosphate(2-)
A doubly-charged organophosphate oxoanion arising from deprotonation of the phosphate OH groups of L-ribulose 5-phosphate; major species at pH 7.3.
D-ribofuranose 5-phosphate(2-)
An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of D-ribofuranose-5-phosphate; major species at pH 7.3.
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
(3r)-7-chloro-5,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
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"}
6-hydroxy-9h-pyrido[3,4-b]indole-1-carboxylic acid
7-chloro-4,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
1-hydroxy-4-methylpyrrolo[3,4-b]quinoline-3,9-dione
4-chloro-6,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
n-{4-methyl-5-oxo-[1,2]dithiolo[4,3-b]pyrrol-6-yl}ethanimidic acid
(3r)-7-chloro-3,6,8-trihydroxy-3,4-dihydro-2h-naphthalen-1-one
C10H9ClO4 (228.01893439999998)
(3r,4s)-7-chloro-4,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
2-(1-chloro-3-hydroxyprop-1-en-2-yl)-4-methoxy-5-methylphenol
(3s)-3-[(carboxycarbonyl)oxy]-2-hydroxycyclohexa-1,5-diene-1-carboxylic acid
5-[4-(furan-2-yl)but-3-en-1-yn-1-yl]thiophene-2-carbaldehyde
2-[(1z)-1-chloro-3-hydroxyprop-1-en-2-yl]-4-methoxy-5-methylphenol
(3r,4r)-4-chloro-6,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
(5-chloro-4-hydroxy-1,3-dihydro-2-benzofuran-1-yl)acetic acid
C10H9ClO4 (228.01893439999998)
7-chloro-5,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
(4as,8ar)-8-chloro-5,7-dihydroxy-2-methyl-4a,8a-dihydrochromen-4-one
C10H9ClO4 (228.01893439999998)
1-hydroxy-9h-pyrido[3,4-b]indole-3-carboxylic acid
methyl 4,6,7-trihydroxy-2h-1,3-benzodioxole-5-carboxylate
2-(prop-1-yn-1-yl)-5-[2-(thiophen-2-yl)ethynyl]thiophene
(3s,4s)-4-chloro-6,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
7-chloro-3,6,8-trihydroxy-3,4-dihydro-2h-naphthalen-1-one
C10H9ClO4 (228.01893439999998)
[(1s)-5-chloro-4-hydroxy-1,3-dihydro-2-benzofuran-1-yl]acetic acid
C10H9ClO4 (228.01893439999998)
(3r,4r)-7-chloro-4,8-dihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
C10H9ClO4 (228.01893439999998)
5-[(3e)-4-(furan-2-yl)but-3-en-1-yn-1-yl]thiophene-2-carbaldehyde
3-(1,3-thiazole-2-carbonyl)-1h-indole
C12H8N2OS (228.03573179999998)