Exact Mass: 210.0678
Exact Mass Matches: 210.0678
Found 500 metabolites which its exact mass value is equals to given mass value 210.0678,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
5-Hydroxyferulic acid
5-Hydroxyferulic acid (CAS: 1782-55-4), also known as 3-(3,4-dihydroxy-5-methoxy)-2-propenoic acid, belongs to the class of organic compounds known as hydroxycinnamic acids. Hydroxycinnamic acids are compounds containing a cinnamic acid where the benzene ring is hydroxylated. Outside of the human body, 5-hydroxyferulic acid has been detected, but not quantified in, several different foods, such as common salsifies, napa cabbages, sparkleberries, nectarines, and Chinese chestnuts. This could make 5-hydroxyferulic acid a potential biomarker for the consumption of these foods. 5-Hydroxyferulic acid is found in green vegetables. 5-Hydroxyferulic acid is isolated from bamboo (Phyllostachys edulis). 5-hydroxyferulic acid is ferulic acid in which the ring hydrogen at position 5 is substituted by a hydroxy group. It is a hydroxycinnamic acid and a methoxycinnamic acid. It is a conjugate acid of a 5-hydroxyferulate. 5-Hydroxyferulic acid is a natural product found in Arabidopsis thaliana, Sabia japonica, and other organisms with data available. Isolated from bamboo (Phyllostachys edulis). 5-Hydroxyferulic acid is found in many foods, some of which are napa cabbage, chervil, common bean, and saskatoon berry. 5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate[1][2][3]. 5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate[1][2][3].
1,3,7-trimethylurate
1,3,7-Trimethyluric acid is a methyl derivative of uric acid, found occasionally in human urine. 1,3,7-Trimethyluracil is one of the purine components in urinary calculi. Methylated purines originate from the metabolism of methylxanthines (caffeine, theophylline and theobromine). Methyluric acids are indistinguishable from uric acid by simple methods routinely used in clinical laboratories, requiring the use of high-performance liquid chromatography (HPLC). Purine derivatives in urinary calculi could be considered markers of abnormal purine metabolism. The content of a purine derivative in stone depends on its average urinary excretion in the general population, similarity to the chemical structure of uric acid, and content of the latter in stone. This suggests that purines in stones represent a solid solution with uric acid as solvent. It is also plausible that methylxanthines, ubiquitous components of the diet and drugs, are involved in the pathogenesis of urolithiasis. Caffeine is metabolized via successive pathways mainly catalyzed by CYP1A2, xanthine oxidase or N-acetyltransferase-2 to give 14 different metabolites. CYP1A2 activity shows an inter-individual variability among the population. CYP1A2, an isoform of the CYP1A cytochrome P450 super-family, is involved in the metabolism of many drugs and plays a potentially important role in the induction of chemical carcinogenesis. (PMID:11712316, 15833286, 3506820, 15013152).
Pyocyanin
An iminium betaine that is 5-methylphenazin-5-ium which is substituted at position 1 by an oxidanidyl group. An antibiotic pigment produced by Pseudomonas aeruginosa. CONFIDENCE standard compound; INTERNAL_ID 184 Pyocyanin (Pyocyanine) is a phenazine that is a toxic, quorum sensing (QS)-controlled metabolite produced by P. aeruginosa. Pyocyanin is a redox-active compound and promotes the generation of reactive oxygen species (ROS). Pyocyanin also possesses antibacterial properties and increases fitness in competition with other bacterial species[1].
L-galacto-2-Heptulose
L-galacto-2-Heptulose (CAS: 29325-35-7) is found in cereals and cereal products. L-galacto-2-Heptulose is isolated from leaves of Medicago sativa (alfalfa). Isolated from leaves of Medicago sativa (alfalfa). L-Galacto-2-heptulose is found in cereals and cereal products.
Thiolactomycin
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents
2-Aminoacridone
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes
Crocose
Crocose, also known as D-altro-3-heptulose, is a member of the class of compounds known as heptoses. Heptoses are monosaccharides in which the sugar unit is a seven-carbon containing moeity. Crocose is soluble (in water) and a very weakly acidic compound (based on its pKa). Crocose can be found in saffron, which makes crocose a potential biomarker for the consumption of this food product.
D-manno-2-Heptulose
D-manno-2-Heptulose (CAS: 3615-44-9) is found in Persea gratissima (avocado) and Medicago sativa (alfalfa). D-Manno-2-heptulose is found in many foods, including fruits, cereals and cereal products, and opium poppy. Occurs in Persea gratissima (avocado) and Medicago sativa (alfalfa). D-Manno-2-heptulose is found in many foods, some of which are fruits, cereals and cereal products, avocado, and opium poppy. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3]. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3].
2,4-Diacetylphloroglucinol
A benzenetriol that is phloroglucinol in which two of the ring hydrogens are replaced by acetyl groups. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D013501 - Surface-Active Agents > D003902 - Detergents
D-altro-D-manno-Heptose
D-altro-D-manno-Heptose is found combined in bakers yeas D000970 - Antineoplastic Agents > D020032 - Tyrphostins
Sedoheptulose
Sedoheptulose (CAS: 3019-74-7) is a ketoheptose, a monosaccharide with seven carbon atoms and a ketone functional group. It is one of the few heptoses found in nature. Sedoheptulose is a seven-carbon ketose sugar originally found in Sedum spectabile, a common perennial garden plant. Later it was shown to be widely distributed in the plants of the Crassulaceae family. The Crassulaceae, or orpine family, is a family of dicotyledons. They store water in their succulent leaves. They are found worldwide, but mostly occur in the northern hemisphere and southern Africa, typically in dry and/or cold areas where water may be scarce. The family includes about 1,400 species in 33 genera. As a result, this sugar is often found to be part of the human diet. This sugar, D-sedoheptulose, is a significant intermediary compound in the cyclic regeneration of D-ribulose. It also plays an important role as a transitory compound in the cyclic regeneration of D-ribulose for carbon dioxide fixation in plant photosynthesis. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3]. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3].
3-(2,4-dihydroxy-5-methoxyphenyl)prop-2-enoic acid
1,3,9-Trimethyluric acid
1,3,9-Trimethyluric acid is found in coffee and coffee products. 1,3,9-Trimethyluric acid is present in roasted coffee beans and instant coffee, but not green coffee beans. Present in roasted coffee beans and instant coffee, but not green coffee beans. 1,3,9-Trimethyluric acid is found in coffee and coffee products.
Vanilpyruvic acid
Vanilpyruvic acid is a catecholamine metabolite and precursor to vanilactic acid. Accumulation in urine is indicative of Aromatic L-aminoacid decarboxylase deficiency (PMID 16288991). [HMDB] Vanilpyruvic acid is a catecholamine metabolite and precursor to vanilactic acid. Accumulation in urine is indicative of Aromatic L-aminoacid decarboxylase deficiency (PMID 16288991). Vanilpyruvic acid is a catecholamine metabolite and precursor to vanillactic acid. Vanilpyruvic acid is a catecholamine metabolite and precursor to vanillactic acid.
N-Carbamoyl-2-amino-2-(4-hydroxyphenyl)acetic acid
N-Carbamoyl-2-amino-2-(4-hydroxyphenyl)acetic acid is found in pulses. N-Carbamoyl-2-amino-2-(4-hydroxyphenyl)acetic acid is isolated from leaves of Vicia fab
Ethyl 1-(propylthio)propyl disulfide
Ethyl 1-(propylthio)propyl disulfide is found in fruits. Ethyl 1-(propylthio)propyl disulfide is a constituent of the fruit of Durio zibethinus (durian). Constituent of the fruit of Durio zibethinus (durian). Ethyl 1-(propylthio)propyl disulfide is found in fruits.
Butyl 1-(methylthio)propyl disulfide
Butyl 1-(methylthio)propyl disulfide is found in onion-family vegetables. Butyl 1-(methylthio)propyl disulfide is a constituent of Allium tuberosum (Chinese chives). Constituent of Allium tuberosum (Chinese chives). Butyl 1-(methylthio)propyl disulfide is found in onion-family vegetables.
N-(5-Amino-2-hydroxybenzoyl)glycine
N-(5-Amino-2-hydroxybenzoyl)glycine belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine.
d-Glycero-d-galacto-heptose
D-glycero-d-galactoheptose is a member of the class of compounds known as heptoses. Heptoses are monosaccharides in which the sugar unit is a seven-carbon containing moeity. D-glycero-d-galactoheptose is soluble (in water) and a very weakly acidic compound (based on its pKa). D-glycero-d-galactoheptose can be found in avocado, which makes D-glycero-d-galactoheptose a potential biomarker for the consumption of this food product.
1,2-Didehydro,2,3-dihydro (Z-)-(Z)-6-[4-(Methylthio)-1,2,3-pentatrienyl]-2H-pyran-2-one|1-2-Didehydro,2-3-dihydro (E-)-(E)-6-[4-(Methylthio)-1,2,3-pentatrienyl]-2H-pyran-2-one
7,9-Dihydro-3,7,9-trimethyl-1H-purine-2,6,8(3H)-trione
3,4-Dihydro-5,6,8-trihydroxy-3-methyl-1H-2-benzopyran-1-one
3,4,6,8-Tetrahydroxy-3,4-dihydronaphthalen-1(2H)-one
(3RS)-3,5,7-Trihydroxy-4,6-dimethyl-1(3H)-isobenzofuranon
1-Acetyl-beta-carboline
A natural product found in Marinactinospora thermotolerans and Cordyceps sinensis.
(Z)-3-(3,4-dihydroxyphenyl)-2-hydroxyprop-2-enoic acid methyl ester
3-Me ether,2-Ac-2,3-Dihydroxy-5-methyl-1,4-benzoquinone
1-(5-(HYDROXYMETHYL)-2,5-DIHYDROFURAN-2-YL)PYRIMIDINE-2,4(1H,3H)-DIONE
3R-4,6-dihydroxy-3-methoxy-5-methylphthalide|rubralide C
Mannoheptulose
D-keto-manno-heptulose is the open chain form of D-manno-heptulose. D-Mannoheptulose is a natural product found in Papaver somniferum with data available. A 7-carbon keto sugar having the mannose configuration. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3]. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3].
Imidacloprid-guanidine
CONFIDENCE standard compound; INTERNAL_ID 2592 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3059
1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanone
(3R)-5,6,8-trihydroxy-3-methyl-3,4-dihydroisochromen-1-one
4,6,8-trihydroxy-3-methyl-3,4-dihydroisochromen-1-one
Hydroxy Ferulic Acid
5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate[1][2][3]. 5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate[1][2][3].
1,3,7-Trimethyluric acid
An oxopurine in which the purine ring is substituted by oxo groups at positions 2, 6, and 8, and the nitrogens at positions 1, 3, and 7 are substituted by methyl groups. It is a metabolite of caffeine.
5-aminosalicyluric acid
An N-acylglycine in which the acyl group is specified as 5-amino-2-hydroxybenzoyl.
Vanilpyruvic acid
A 2-oxo monocarboxylic acid that is 3,4-dihydroxyphenylpyruvic acid in which the hydroxy group at position 3 is substituted by a methoxy group. Vanilpyruvic acid is a catecholamine metabolite and precursor to vanillactic acid. Vanilpyruvic acid is a catecholamine metabolite and precursor to vanillactic acid.
Sanazin
Pyocyanin (Pyocyanine) is a phenazine that is a toxic, quorum sensing (QS)-controlled metabolite produced by P. aeruginosa. Pyocyanin is a redox-active compound and promotes the generation of reactive oxygen species (ROS). Pyocyanin also possesses antibacterial properties and increases fitness in competition with other bacterial species[1].
2-(carbamoylamino)-2-(4-hydroxyphenyl)acetic acid
2l5-1,3,2-Dioxaphosphole,2,2,2-trimethoxy-4,5-dimethyl-
1-(4-CHLOROPHENYL)-3-(2-HYDROXYPHENYL)PROPANE-1,3-DIONE
5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid
1H-1,2,4-Triazole-3-carboxylicacid,5-[(cyclopropylcarbonyl)amino]-,methyl
5-Ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid
4,5,6,7,8,9-Hexahydrocycloocta[b]thiophene-2-carboxylic acid
1-(2-chloropyridin-3-yl)-3,3-dimethylazetidin-2-one
3-[2-(3-hydroxypropylsulfanyl)ethylsulfanyl]propan-1-ol
5-CHLORO-1,2,3,4-TETRAHYDRO-NAPHTHALEN-1-YLAMINEHYDROCHLORIDE
4-Pyridinecarboxylicacid, 2-[(methylamino)thioxomethyl]hydrazide
METHYL 5-(2-METHOXYCARBONYLVINYL)FURAN-2-CARBOXYLATE
2-tert-butyl-6-chloro-[1,2,4]triazolo[1,5-b]pyridazine
2-(2,4-Dichlorophenoxy)-1-(2-Methyl-1-piperidyl)-1-propanone
Ethyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
5,7-Dihydroxy-2,2-dimethyl-4H-1,3-benzodioxin-4-one
Benzoicacid,4-amino-3-methyl-5-nitro-,methylester(9CI)
Benzoic acid, 4-(1-aminoethyl)-3-nitro-, (R)- (9CI)
2-AMINO-6-METHYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE
3-Pyridinecarbonitrile,1,2-dihydro-6-methyl-2-oxo-4-phenyl-
3-acetylamino-6-Methoxy-pyridine-2-carboxylic acid
6-Methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
2-Amino-N-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-[(2Z)-Piperazin-2-ylidene]trifluoroacetohydrazide
1H-Purine-2,6-dione,3,9-dihydro-8-(hydroxymethyl)-1,3-dimethyl-
1-vinyl-1H-imidazole-4,5-dicarboxylic acid dimethyl ester
5-(Aminomethyl)-3-(3-fluorophenyl)-2-oxazolidinone
ETHYL 4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE-3-CARBOXYLATE
(4R,5R)-2-CHLORO-4,5-DIMETHYL-1,3,2-DIOXAPHOSPHOLANE2-OXIDE
9,9-DIMETHYL-3,7-DIAZABICYCLO[3.3.1]NONANE-2,4,6,8-TETRAONE
3-(4-Hydroxy-3-Imino-6-Oxo-Cyclohexa-1,4-Dienyl)-Alanine
(3S,5E)-3-propyl-3,4-dihydrothieno[2,3-f][1,4]oxazepin-5(2H)-imine
(3R)-8-(dioxidosulfanyl)-3-methyl-1,2,3,4-tetrahydroquinoline
1782-55-4
5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate[1][2][3]. 5-Hydroxyferulic acid is a hydroxycinnamic acid and is a metabolite of the phenylpropanoid pathway. 5-Hydroxyferulic acid is a precursor in the biosynthesis of sinapic acid and is also a COMT non-esterifed substrate[1][2][3].
1,3,7-Trimethylurate
1,3,7-trimethyluric acid, also known as 8-oxy-caffeine or 137-trimethylate, is a member of the class of compounds known as xanthines. Xanthines are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety. 1,3,7-trimethyluric acid is soluble (in water) and a very weakly acidic compound (based on its pKa). 1,3,7-trimethyluric acid can be found in a number of food items such as devilfish, allium (onion), cocoa bean, and epazote, which makes 1,3,7-trimethyluric acid a potential biomarker for the consumption of these food products. 1,3,7-trimethyluric acid can be found primarily in blood, feces, and urine, as well as in human kidney and liver tissues. In humans, 1,3,7-trimethyluric acid is involved in the caffeine metabolism. Moreover, 1,3,7-trimethyluric acid is found to be associated with asthma. 1,3,7-Trimethyluric acid, also referred to as trimethyluric acid and 8-oxy-caffeine, is a purine alkaloid that is produced in some plants and occurs as a minor metabolite of caffeine in humans. The enzymes that metabolize caffeine into 1,3,7-trimethyluric acid in humans include CYP1A2, CYP2E1, CYP2C8, CYP2C9, and CYP3A4 .
3,4-Dihydro-3-methyl-4,6,8-trihydroxy-1H-2-benzopyran-1-one
N-(5-Amino-2-hydroxybenzoyl)glycine
N-(5-Amino-2-hydroxybenzoyl)glycine belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine.
D-glycero-D-gulo-heptopyranose
An aldoheptose that is the D-glycero-diastereomer of D-gulo-heptopyranose
Calcium 4-(1-oxidopropylidene)-3,5-dioxocyclohexanecarboxylate
(2E)-3-(2,4-dihydroxy-5-methoxyphenyl)prop-2-enoic acid
(Z)-3-(2,4-dihydroxy-5-methoxyphenyl)prop-2-enoic acid
N-(5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
3-Propyl-2,3-dihydrothieno[2,3-][1,4]oxazepin-5-amine
3-amino-9-oxo-9H-imidazo[1,2-a]indole-2-carbonitrile
1,3-Dimethyl-1,9A-dihydro-2H-pyrimido(1,2-A)(1,3,5)triazine-2,4,8(3H,9H)-trione
D-Mannoheptulose
D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3]. D-Mannoheptulose is a major non-structural carbohydrate in avocado. D-mannoheptulose is a specific inhibitor of D-glucose phosphorylation. D-Mannoheptulose can block insulin release and utilization of carbohydrate in rat[1][2][3].
2-aminoacridone
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes
6-(1,2-dihydroxyethyl)oxane-2,3,4,5-tetrol
D000970 - Antineoplastic Agents > D020032 - Tyrphostins
Methoxy-PEPy
Methoxy-PEPy is a potent and highly selective mGlu5 receptor antagonist with IC50 of 1 nM. IC50 value: 1 nM [1] Target: mGlu5R inhibitor Administration of [3H]methoxy-PEPy (50 microCi/kg i.v.) to mGlu5 receptor-deficient mice revealed binding at background levels in forebrain, whereas wild-type mice exhibited 14-fold higher binding in forebrain relative to cerebellum [2]. The calcium transients stimulated by these agonists were potently inhibited by reference allosteric mGlu5 antagonists - 2-methyl-6-(phenylethynyl)pyridine (MPEP), 3-[(2-methyl-1,3-thiazol-4-yl)ethynyl]pyridine (MTEP) and 3-methoxy-5-(pyridine-2-ylethynyl)pyridine (methoxy-PEPy) (IC(50) ranges: 0.8-66 nM) [3].
4,7,8-trihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
(3r)-3,5,7-trihydroxy-4,6-dimethyl-3h-2-benzofuran-1-one
(3r,4s)-4,7,8-trihydroxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
3,5,7-trihydroxy-4,6-dimethyl-3h-2-benzofuran-1-one
(2z)-3-(5-hydroxy-2-methyl-6-oxopyran-3-yl)-2-methylprop-2-enoic acid
(1r,2s,3s,8r,10s)-4-(hydroxymethyl)-7,9,11-trioxatetracyclo[6.4.0.0²,⁶.0³,¹⁰]dodec-4-en-12-one
,2,4-dihydroxyacetophenone
{"Ingredient_id": "HBIN004331","Ingredient_name": ",2,4-dihydroxyacetophenone","Alias": "NA","Ingredient_formula": "C10H10O5","Ingredient_Smile": "CC(=O)C1=C(C=C(C=C1OC(=O)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42739","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
