Exact Mass: 168.08742819999998
Exact Mass Matches: 168.08742819999998
Found 500 metabolites which its exact mass value is equals to given mass value 168.08742819999998,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Veratrole_alcohol
(3,4-dimethoxyphenyl)methanol is a member of the class of benzyl alcohols that is benzyl alcohol in which the hydrogens at positions 3 and 4 of the phenyl group are substituted by methoxy groups. It has a role as a fungal metabolite. It is a member of benzyl alcohols, a primary alcohol and a dimethoxybenzene. 3,4-Dimethoxybenzyl alcohol is a natural product found in Croton lechleri and Cucurbita pepo with data available. A member of the class of benzyl alcohols that is benzyl alcohol in which the hydrogens at positions 3 and 4 of the phenyl group are substituted by methoxy groups. Veratryl alcohol (3,4-Dimethoxybenzenemethanol), a secondary metabolite of some lignin degrading fungi, is commonly used nonphenolic substrate for assaying ligninolytic activity[1][2]. Veratryl alcohol (3,4-Dimethoxybenzenemethanol), a secondary metabolite of some lignin degrading fungi, is commonly used nonphenolic substrate for assaying ligninolytic activity[1][2].
Pyridoxamine
Pyridoxamine is one form of vitamin B6. Chemically it is based on a pyridine ring structure, with hydroxyl, methyl, aminomethyl, and hydroxymethyl substituents. It differs from pyridoxine by the substituent at the 4-position. The hydroxyl at position 3 and aminomethyl group at position 4 of its ring endow pyridoxamine with a variety of chemical properties, including the scavenging of free radical species and carbonyl species formed in sugar and lipid degradation and chelation of metal ions that catalyze Amadori reactions. Pyridoxamine, also known as PM, belongs to the class of organic compounds known as pyridoxamine 5-phosphates. These are heterocyclic aromatic compounds containing a pyridoxamine that carries a phosphate group at the 5-position. Within humans, pyridoxamine participates in a number of enzymatic reactions. In particular, pyridoxamine can be converted into pyridoxal; which is mediated by the enzyme pyridoxine-5-phosphate oxidase. In addition, pyridoxamine can be converted into pyridoxamine 5-phosphate; which is catalyzed by the enzyme pyridoxal kinase. Pyridoxamine also inhibits the formation of advanced lipoxidation endproducts during lipid peroxidation reactions by reaction with dicarbonyl intermediates. In humans, pyridoxamine is involved in vitamin B6 metabolism. Outside of the human body, pyridoxamine has been detected, but not quantified in several different foods, such as nutmegs, sparkleberries, fennels, turmerics, and swiss chards. Pyridoxamine inhibits the Maillard reaction and can block the formation of advanced glycation endproducts, which are associated with medical complications of diabetes. Pyridoxamine is hypothesized to trap intermediates in the formation of Amadori products released from glycated proteins, possibly preventing the breakdown of glycated proteins by disrupting the catalysis of this process through disruptive interactions with the metal ions crucial to the redox reaction. One research study found that pyridoxamine specifically reacts with the carbonyl group in Amadori products, but inhibition of post-Amadori reactions (that can lead to advanced glycation endproducts) is due in much greater part to the metal chelation effects of pyridoxamine. The 4-aminomethyl form of vitamin B6. During transamination of amino acids, pyridoxal phosphate is transiently converted into pyridoxamine phosphate. -- Pubchem; Pyridoxamine is one of the compounds that can be called vitamin B6, along with Pyridoxal and Pyridoxine. -- Wikipedia [HMDB]. Pyridoxamine is found in many foods, some of which are cucumber, fox grape, millet, and teff. Acquisition and generation of the data is financially supported in part by CREST/JST. D018977 - Micronutrients > D014815 - Vitamins KEIO_ID P116 Pyridoxylamine is an advanced glycation end production (AGEs) and lipoxidation end products (ALEs) inhibitor, to protect against diabetes-induced retinal vascular lesions.
beta-Carboline
beta-Carboline, also known as norharmane, is an organic amine and is the prototype of a class of compounds known as beta-carbolines. beta-Carbolines are compounds containing a 9H-pyrido[3,4-b]indole moiety. beta-Carboline is a very strong basic compound (based on its pKa). beta-Carboline alkaloids are widely distributed in plants and animals and many are inverse agonists of the GABA-A receptor complex (PMID: 17334612). Other biological activities demonstrated by these compounds include intercalation; inhibition of CDK, topoisomerase, and monoamine oxidase; and interaction with 5-hydroxy serotonin receptors. These compounds have also exhibited sedative, anxiolytic, hypnotic, anticonvulsant, antitumor, antiviral, antiparasitic, and antimicrobial activities (PMID: 17305548). b-Carboline (9H-pyrido[3,4-b]indole) is an organic amine that is the prototype of a class of compounds known as b-carbolines. [HMDB]. Norharman is found in chicory. CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 75 CONFIDENCE standard compound; INTERNAL_ID 2883 D009676 - Noxae > D009498 - Neurotoxins D009676 - Noxae > D009153 - Mutagens Norharmane (Norharman), a β-carboline alkaloid, is a potent and reversible monoamine oxidase inhibitor, with IC50 values of 6.5 and 4.7 μM for MAO-A and MAO-B, respectively. Norharmane causes antidepressant responses. Norharmane is also a prospective anti-cancer photosensitizer. Norharmane alters polar auxin transport (PAT) by inhibiting PIN2, PIN3 and PIN7 transport proteins, thus causing a significant inhibitory effect on the growth of Arabidopsis thaliana seedlings[1][2][3][4][5][6]. Norharmane (Norharman), a β-carboline alkaloid, is a potent and reversible monoamine oxidase inhibitor, with IC50 values of 6.5 and 4.7 μM for MAO-A and MAO-B, respectively. Norharmane causes antidepressant responses. Norharmane is also a prospective anti-cancer photosensitizer. Norharmane alters polar auxin transport (PAT) by inhibiting PIN2, PIN3 and PIN7 transport proteins, thus causing a significant inhibitory effect on the growth of Arabidopsis thaliana seedlings[1][2][3][4][5][6].
2-Trimethylaminoethylphosphonic acid
A quaternary ammonium ion where three methyl groups and one 2-phosphoethyl group are attached to the nitrogen.
Cyclo(deltaAla-L-Val)
A 2,5-diketopiperazine where the substituents are methylidene and (S)-isopropyl at positions 3 and 6 respectively.
5-(3-Methyl-1-triazeno)imidazole-4-carboxamide
D009676 - Noxae > D000477 - Alkylating Agents
(4-Hydroxy-3-methoxyphenyl)ethanol
(4-Hydroxy-3-methoxyphenyl)ethanol is a member of methoxybenzenes and a member of phenols. Homovanillyl alcohol is a natural product found in Saussurea medusa, Urtica dioica, and other organisms with data available. Homovanillyl alcohol is a metabolite found in or produced by Saccharomyces cerevisiae. Metabolite of serotonin and norepinephrine. (4-Hydroxy-3-methoxyphenyl)ethanol is isolated from various plant species (4-Hydroxy-3-methoxyphenyl)ethanol is a constituent of mandibular secretion of honeybees [CCD]. Isolated from various plant subspecies Constituent of mandibular secretion of honeybees [CCD] Homovanillyl alcohol is a biological metabolite of Hydroxytyrosol. Hydroxytyrosol is a phenolic compound that is present in virgin olive oil (VOO) and wine. Homovanillyl alcohol protects red blood cells (RBCs) from oxidative injury and has protective effect on cardiovascular disease[1][2]. Homovanillyl alcohol is a biological metabolite of Hydroxytyrosol. Hydroxytyrosol is a phenolic compound that is present in virgin olive oil (VOO) and wine. Homovanillyl alcohol protects red blood cells (RBCs) from oxidative injury and has protective effect on cardiovascular disease[1][2].
2,6-Dimethoxy-4-methylphenol
2,6-Dimethoxy-4-methylphenol is found in animal foods. 2,6-Dimethoxy-4-methylphenol is present in smoked fish and pork. 2,6-Dimethoxy-4-methylphenol is a flavouring ingredien Present in smoked fish and pork. Flavouring ingredient. 2,6-Dimethoxy-4-methylphenol is found in fishes and animal foods. 2,6-Dimethoxy-4-methylphenol is a member of methoxybenzenes and a member of phenols. 4-Methylsyringol is a natural product that can be isolated from hardwood[1]. 4-Methylsyringol is a natural product that can be isolated from hardwood[1].
1,3,5-Trimethoxybenzene
1,3,5-Trimethoxybenzene has been found to be a potential biomarker of flavonoid intake in human. Flavonoids are phytochemicals that are widespread in the human diet. Despite limitations in their bioavailability, experimental and epidemiological data suggest health benefits of flavonoid consumption. Valid biomarkers of flavonoid intake may be useful for estimating exposure in a range of settings. However, to date, few useful flavonoid biomarkers have been identified. A recent urine analysis suggested that urinary 4-ethylphenol, benzoic acid, and 4-ethylbenzoic acid may be potential biomarkers of quercetin intake and 1,3,5-trimethoxybenzene, 4-O-methylgallic acid, 3-O-methylgallic acid, and gallic acid may be potential markers of epigallocatechin gallate intake. Potential biomarkers of (-)-epicatechin were not identified. These urinary biomarkers may provide an accurate indication of flavonoid exposure (PMID: 19812218). 1,3,5-trimethoxybenzene is a methoxybenzene carrying methoxy groups at positions 1, 3 and 5. It has been found to be a biomarker of flavonoid consumption in humans. It has a role as a biomarker and a human xenobiotic metabolite. 1,3,5-Trimethoxybenzene is a natural product found in Zieria chevalieri, Virola surinamensis, and other organisms with data available. A polyphenol metabolite detected in biological fluids [PhenolExplorer]. 1,3,5-Trimethoxybenzene is found in many foods, some of which are carob, coriander, plains prickly pear, and italian sweet red pepper. A methoxybenzene carrying methoxy groups at positions 1, 3 and 5. It has been found to be a biomarker of flavonoid consumption in humans. D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics 1,3,5-Trimethoxybenzene is a key component of the Chinese rose odor. 1,3,5-Trimethoxybenzene is synthesized in three successive methylation steps from phloroglucinol, the initial precursor[1].
(E,E,E)-1,3,5,11-Tridecatetraene-7,9-diyne
(3Z,5E,11E)-1,3,5,11-Tridecatetraene-7,9-diyne is found in fats and oils. (3Z,5E,11E)-1,3,5,11-Tridecatetraene-7,9-diyne is isolated from Carthamus tinctorius (safflower). Isolated from Carthamus tinctorius (safflower). (3Z,5E,11E)-1,3,5,11-Tridecatetraene-7,9-diyne is found in fats and oils and herbs and spices.
4-Methylbiphenyl
4-Methylbiphenyl is found in cocoa and cocoa products. 4-Methylbiphenyl is present in cocoa. 4-Methylbiphenyl is a flavouring ingredien Present in cocoa. Flavouring ingredient. 4-Methylbiphenyl is found in cocoa and cocoa products. 4-Methylbiphenyl is an endogenous metabolite.
4-Ipomeanol
4-Ipomeanol is found in root vegetables. 4-Ipomeanol is produced on Fusarium solani and Ceratocystis fimbriata-damaged sweet potatoes (Ipomoea batatus C274 - Antineoplastic Agent > C1931 - Antineoplastic Plant Product D000970 - Antineoplastic Agents C1907 - Drug, Natural Product
2,4,6,8-Tridecatetrayne
2,4,6,8-Tridecatetrayne is found in mushrooms. Metabolite of Fistulina hepatica (beefsteak fungus
1-Ipomeanol
1-Ipomeanol is found in root vegetables. 1-Ipomeanol is produced on Fusarium solani-infected sweet potatoes (Ipomoea batatus
Epoxyoxophorone
Epoxyoxophorone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
2-Hexylthiophene
2-Hexylthiophene is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") 2-Hexylthiophene is an extremely weak basic heteroaromatic compound. 2-Hexylthiophene can be used to modify and improve the molar absorption coefficient of ruthenium sensitizer[1]
Ethyl 2-furanpropionate
Ethyl 2-furanpropionate is found in alcoholic beverages. Ethyl 2-furanpropionate is present in rum. Ethyl 2-furanpropionate is a flavouring ingredient. Present in rum. Flavouring ingredient. Ethyl 2-furanpropionate is found in alcoholic beverages.
2-Furanylmethyl butanoate
2-Furanylmethyl butanoate is a flavouring ingredient. Flavouring ingredient
Hexamethylene diisocyanate
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D003432 - Cross-Linking Reagents D004785 - Environmental Pollutants > D000393 - Air Pollutants
3-Methyl-(triazen-1-yl)imidazole-4-carboxamide
(Methyl-triazene-1-yl)-imidazole-4-carboxamide
3E,5E,11E-Trideca-1,3,5,11-tetraene-7,9-diyne
3e,5e,11e-trideca-1,3,5,11-tetraene-7,9-diyne is a member of the class of compounds known as enynes. Enynes are hydrocarbons containing an alkene and an alkyne group. 3e,5e,11e-trideca-1,3,5,11-tetraene-7,9-diyne can be found in safflower, which makes 3e,5e,11e-trideca-1,3,5,11-tetraene-7,9-diyne a potential biomarker for the consumption of this food product.
3E,5Z,11E-Trideca-1,3,5,11-tetraene-7,9-diyne
3e,5z,11e-trideca-1,3,5,11-tetraene-7,9-diyne is a member of the class of compounds known as enynes. Enynes are hydrocarbons containing an alkene and an alkyne group. 3e,5z,11e-trideca-1,3,5,11-tetraene-7,9-diyne can be found in safflower, which makes 3e,5z,11e-trideca-1,3,5,11-tetraene-7,9-diyne a potential biomarker for the consumption of this food product.
2-Methylthio-3-isopropylpyrazine
2-methylthio-3-isopropylpyrazine is a member of the class of compounds known as aryl thioethers. Aryl thioethers are organosulfur compounds containing a thioether group that is substituted by an aryl group. 2-methylthio-3-isopropylpyrazine is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 2-methylthio-3-isopropylpyrazine can be found in fenugreek, which makes 2-methylthio-3-isopropylpyrazine a potential biomarker for the consumption of this food product.
L,L-Cyclo(prolylalanyl)
Isolated from cocoa. L,L-Cyclo(prolylalanyl) is found in cocoa and cocoa products.
1,2,3-Trimethoxybenzene
1,2,3-trimethoxybenzene, also known as methylsyringol or pyrogallol trimethyl ether, is a member of the class of compounds known as anisoles. Anisoles are organic compounds containing a methoxybenzene or a derivative thereof. 1,2,3-trimethoxybenzene is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 1,2,3-trimethoxybenzene can be found in tea, which makes 1,2,3-trimethoxybenzene a potential biomarker for the consumption of this food product. 1,2,3-Trimethoxybenzene is a member of the class of compounds known as anisoles. 1,2,3-Trimethoxybenzene can be found in tea, which makes 1,2,3-trimethoxybenzene a potential biomarker for the consumption of this food product.
3,4-Dimethoxybenzyl alcohol
Veratryl alcohol (3,4-Dimethoxybenzenemethanol), a secondary metabolite of some lignin degrading fungi, is commonly used nonphenolic substrate for assaying ligninolytic activity[1][2]. Veratryl alcohol (3,4-Dimethoxybenzenemethanol), a secondary metabolite of some lignin degrading fungi, is commonly used nonphenolic substrate for assaying ligninolytic activity[1][2].
1,3,5-Trimethoxybenzene
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics 1,3,5-Trimethoxybenzene is a key component of the Chinese rose odor. 1,3,5-Trimethoxybenzene is synthesized in three successive methylation steps from phloroglucinol, the initial precursor[1].
dimethoxyanisole
A methoxybenzene that is benzene substituted by methoxy groups at positions 1, 2 and 3 respectively. 1,2,3-Trimethoxybenzene is a member of the class of compounds known as anisoles. 1,2,3-Trimethoxybenzene can be found in tea, which makes 1,2,3-trimethoxybenzene a potential biomarker for the consumption of this food product.
1,7-(Epoxymethano)-1,3,4,4a,7,7a-hexahydrocyclopenta[c]pyran-7-ol
(+-)-1,2,7-Trihydroxy-nona-3,5-diin|(2R,7S)-3,5-Nonadiyne-1,2,7-triol|(2R,7S)-nona-3,5-diyne-1,2,7-triol|1,2,7-Trihydroxy-nona-3,5-diin|3,5-Nonadiyne-1,2,7-triol|Non-3,5-diin-1,2,7-triol|nona-3,5-diyne-1,2,7-triol|Nona-4,6-diin-3,8,9-triol
(2E,4E)-2-((R)-1-hydroxy-2-oxo-propyl)-hexa-2,4-dienal|Avellaneol
1,2,3,4-Tetrahydropyrrolo<2,3-c>-5H-azepine-1,5-diol|1,2,3,4-Tetrahydropyrrolo[2,3-c]-5H-azepine-1,5-diol
3-methoxy-4-methyl-5-prop-1-enylfuran-2(5H)-one|Serpenone
6-ethyl-4-methoxy-3-methyl-2H-pyran-2-one|pestalotiopyrone C
(E)-N-[(E)-2-butenoyl]-2-butenoylhydrazide|N,N-Dicrotonoyl-hydrazin|N,N-dicrotonoyl-hydrazine
2-hydroxy-2,4-dimethyl-5-trans-propenyl-furan-3-one|4-methyl-oct-6t-ene-2,3,5-trione (Z)-4,5-enol 2->5-cyclohemiacetal
Norharmane
D009676 - Noxae > D009498 - Neurotoxins D009676 - Noxae > D009153 - Mutagens IPB_RECORD: 2981; CONFIDENCE confident structure Norharmane (Norharman), a β-carboline alkaloid, is a potent and reversible monoamine oxidase inhibitor, with IC50 values of 6.5 and 4.7 μM for MAO-A and MAO-B, respectively. Norharmane causes antidepressant responses. Norharmane is also a prospective anti-cancer photosensitizer. Norharmane alters polar auxin transport (PAT) by inhibiting PIN2, PIN3 and PIN7 transport proteins, thus causing a significant inhibitory effect on the growth of Arabidopsis thaliana seedlings[1][2][3][4][5][6]. Norharmane (Norharman), a β-carboline alkaloid, is a potent and reversible monoamine oxidase inhibitor, with IC50 values of 6.5 and 4.7 μM for MAO-A and MAO-B, respectively. Norharmane causes antidepressant responses. Norharmane is also a prospective anti-cancer photosensitizer. Norharmane alters polar auxin transport (PAT) by inhibiting PIN2, PIN3 and PIN7 transport proteins, thus causing a significant inhibitory effect on the growth of Arabidopsis thaliana seedlings[1][2][3][4][5][6].
pyridoxamine
A monohydroxypyridine that is pyridine substituted by a hydroxy group at position 3, an aminomethyl group at position 4, a hydroxymethyl group at position 5 and a methyl group at position 2. The 4-aminomethyl form of vitamin B6, it is used (in the form of the hydrochloride salt) for treatment of diabetic nephropathy. D018977 - Micronutrients > D014815 - Vitamins Pyridoxylamine is an advanced glycation end production (AGEs) and lipoxidation end products (ALEs) inhibitor, to protect against diabetes-induced retinal vascular lesions.
Pyridoxylamine
Pyridoxylamine is an advanced glycation end production (AGEs) and lipoxidation end products (ALEs) inhibitor, to protect against diabetes-induced retinal vascular lesions.
Norharman
D009676 - Noxae > D009498 - Neurotoxins D009676 - Noxae > D009153 - Mutagens Annotation level-1 Norharmane (Norharman), a β-carboline alkaloid, is a potent and reversible monoamine oxidase inhibitor, with IC50 values of 6.5 and 4.7 μM for MAO-A and MAO-B, respectively. Norharmane causes antidepressant responses. Norharmane is also a prospective anti-cancer photosensitizer. Norharmane alters polar auxin transport (PAT) by inhibiting PIN2, PIN3 and PIN7 transport proteins, thus causing a significant inhibitory effect on the growth of Arabidopsis thaliana seedlings[1][2][3][4][5][6]. Norharmane (Norharman), a β-carboline alkaloid, is a potent and reversible monoamine oxidase inhibitor, with IC50 values of 6.5 and 4.7 μM for MAO-A and MAO-B, respectively. Norharmane causes antidepressant responses. Norharmane is also a prospective anti-cancer photosensitizer. Norharmane alters polar auxin transport (PAT) by inhibiting PIN2, PIN3 and PIN7 transport proteins, thus causing a significant inhibitory effect on the growth of Arabidopsis thaliana seedlings[1][2][3][4][5][6].
5-Carboline
CONFIDENCE standard compound; INTERNAL_ID 2881 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 71
Carboline
CONFIDENCE standard compound; INTERNAL_ID 2882 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 76
Homovanillyl alcohol
Homovanillyl alcohol is a biological metabolite of Hydroxytyrosol. Hydroxytyrosol is a phenolic compound that is present in virgin olive oil (VOO) and wine. Homovanillyl alcohol protects red blood cells (RBCs) from oxidative injury and has protective effect on cardiovascular disease[1][2]. Homovanillyl alcohol is a biological metabolite of Hydroxytyrosol. Hydroxytyrosol is a phenolic compound that is present in virgin olive oil (VOO) and wine. Homovanillyl alcohol protects red blood cells (RBCs) from oxidative injury and has protective effect on cardiovascular disease[1][2].
4-Methylsyringol
4-Methylsyringol is a natural product that can be isolated from hardwood[1]. 4-Methylsyringol. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=6638-05-7 (retrieved 2024-08-21) (CAS RN: 6638-05-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
2-Hexylthiophene
2-Hexylthiophene is an extremely weak basic heteroaromatic compound. 2-Hexylthiophene can be used to modify and improve the molar absorption coefficient of ruthenium sensitizer[1]
4-Ipomeanol
C274 - Antineoplastic Agent > C1931 - Antineoplastic Plant Product D000970 - Antineoplastic Agents C1907 - Drug, Natural Product
6-Methyl-4,5,6,7-tetrahydrobenzo[d]thiazol-2-amine
1,2-diamino-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-3-one
1H-Imidazole-4-carboxylicacid,2-ethyl-5-methyl-,methylester(9CI)
1H-Imidazole-4-carboxylicacid,2,5-dimethyl-,ethylester(9CI)
1H-Imidazole-2-carboxylicacid,1-methyl-,1-methylethylester(9CI)
1-[Isopropyl(dimethyl)silyl]-1H-imidazole
C8H16N2Si (168.10826960000003)
1H-Imidazole-4-carboxylicacid,5-(1,1-dimethylethyl)-(9CI)
Pyrrolo[1,2-c]pyrimidine-1,4-dione, hexahydro-2-methyl- (9CI)
Cyclohexanecarboxaldehyde, 4,4-dimethyl-2,6-dioxo-
3,4-dimethyl-5-fluoro-phenylboronic acid
C8H10BFO2 (168.07578420000002)
1-(2,2,2-TRIFLUOROETHYL)PIPERAZINE
C6H11F3N2 (168.08742819999998)
H-D-Orn-OH·HCl
C5H13ClN2O2 (168.06655080000002)
D-Ornithine ((R)-Ornithine) hydrochloride is an endogenous metabolite. D-Ornithine ((R)-Ornithine) hydrochloride is an endogenous metabolite.
1H-Imidazole-4-carboxylicacid,1-propyl-,methylester(9CI)
4-AMINO-5-ETHYL-1-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID AMIDE
4-FLUORO-2,3-DIMETHYLPHENYLBORONIC ACID
C8H10BFO2 (168.07578420000002)
1H-Imidazole-1-aceticacid,α-methyl-,ethylester,(alphaS)-(9CI)
N-(3-Aminopropyl)glycine Dihydrochloride
C5H13ClN2O2 (168.06655080000002)
3-Isopropyl-1-methyl-1H-pyrazole-5-carboxylic acid
Spiro[1-azabicyclo[2.2.1]heptane-3,5-oxazolidin]-2-one (9CI)
1H-Imidazole-4-carboxylicacid,1-(1,1-dimethylethyl)-(9CI)
6-Methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-4-amine
1H-Imidazole-4-carboxylicacid,2-ethyl-,ethylester(9CI)
1H-Imidazole-4-carboxylicacid,1,1-dimethylethylester(9CI)
4-Fluoro-2,5-dimethylphenylboronic acid
C8H10BFO2 (168.07578420000002)
1H-Imidazole-2-methanol,1-ethenyl-alpha-ethoxy-(9CI)
1H-Imidazole-4-carboxylicacid,2-(1-methylethyl)-,hydrazide(9CI)
1-(2-cyclopropyl-1,3-thiazol-5-yl)-N-methylmethanamine
Propanamide, N-methyl-N-(5-methyl-4-isoxazolyl)- (9CI)
6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
Pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-2-methyl-, (S)- (9CI)
1H-Pyrrole-2-carboxylicacid,3-amino-4-methyl-,ethylester(9CI)
(1alpha,6alpha,7alpha)-2-Oxobicyclo[4.1.0]heptane-7-carboxylic acid methyl ester
1H-Imidazole-4-carboxylic acid,2-(1,1-dimethylethyl)- (9CI)
2-CYCLOHEXENE-1-CARBOXYLIC ACID, 2-METHYL-4-OXO-, METHYL ESTER
5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-amine
1-ETHYL-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
(3,3-DIMETHYL-6-OXOCYCLOHEX-1-EN-1-YL)BORONIC ACID
1H-1,4-Diazepine-2-carboxylicacid,2,3-dihydro-5,7-dimethyl-(9CI)
1H-Pyrazole-3-carboxylicacid,5-propyl-,methylester(9CI)
2-Cyclopenten-1-one, 2-acetyl-4-hydroxy-3,4-dimethyl- (9CI)
4-Isoxazolecarboxamide,5-methyl-N-(1-methylethyl)-(9CI)
1-ISOPROPYL-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
1-ethyl-3-methyl-1H-pyrazole-4-carbohydrazide(SALTDATA: FREE)
2(1H)-Pyrimidinone, 1-(2-hydroxyethyl)-4,6-dimethyl-
D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D020011 - Protective Agents > D016587 - Antimutagenic Agents D009676 - Noxae > D000963 - Antimetabolites D007155 - Immunologic Factors
L-Ornithine hydrochloride
C5H13ClN2O2 (168.06655080000002)
L-Ornithine hydrochloride is a non-proteinogenic amino acid, is mainly used in urea cycle removing excess nitrogen in vivo. L-Ornithine hydrochloride shows nephroprotective[1][2].
2,4(1H,3H)-Pyrimidinedione, 5-(1,1-dimethylethyl)-
1H-Pyrazole, 3,5-dimethyl-1-(trimethylsilyl)-
C8H16N2Si (168.10826960000003)
3-(3-Oxo-cyclopent-1-enyl)-propionic acid methyl ester
93-03-8
Veratryl alcohol (3,4-Dimethoxybenzenemethanol), a secondary metabolite of some lignin degrading fungi, is commonly used nonphenolic substrate for assaying ligninolytic activity[1][2]. Veratryl alcohol (3,4-Dimethoxybenzenemethanol), a secondary metabolite of some lignin degrading fungi, is commonly used nonphenolic substrate for assaying ligninolytic activity[1][2].
2380-78-1
Homovanillyl alcohol is a biological metabolite of Hydroxytyrosol. Hydroxytyrosol is a phenolic compound that is present in virgin olive oil (VOO) and wine. Homovanillyl alcohol protects red blood cells (RBCs) from oxidative injury and has protective effect on cardiovascular disease[1][2]. Homovanillyl alcohol is a biological metabolite of Hydroxytyrosol. Hydroxytyrosol is a phenolic compound that is present in virgin olive oil (VOO) and wine. Homovanillyl alcohol protects red blood cells (RBCs) from oxidative injury and has protective effect on cardiovascular disease[1][2].
AI3-02077
1,2,3-Trimethoxybenzene is a member of the class of compounds known as anisoles. 1,2,3-Trimethoxybenzene can be found in tea, which makes 1,2,3-trimethoxybenzene a potential biomarker for the consumption of this food product.
Ornithine
C5H13ClN2O2 (168.06655080000002)
A non-essential and nonprotein amino acid, ornithine is critical for the production of the bodys proteins, enzymes and muscle tissue. Ornithine plays a central role in the urea cycle and is important for the disposal of excess nitrogen (ammonia). Ornithine is the starting point for the synthesis of many polyamines such as putrescine and spermine. Ornithine supplements are claimed to enhance the release of growth hormone and to burn excess body fat. Ornithine is necessary for proper immune function and good liver function.; AF112968; L-Ornithine is one of the products of the action of the enzyme arginase on L-arginine, creating urea. Therefore, ornithine is a central part of the urea cycle, which allows for the disposal of excess nitrogen. Ornithine is recycled and in a manner is a catalyst. First, ammonia is converted into carbamoyl phosphate (phosphate-CONH2), which creates one half of urea. Ornithine is converted into a urea derivative at the ? (terminal) nitrogen by carbamoyl phosphate. Another nitrogen is added from aspartate, producing the denitrogenated fumarate, and the resulting arginine (a guanidinium compound) is hydrolysed back to ornithine, producing urea. The nitrogens of urea come from the ammonia and aspartate, and the nitrogen in ornithine remains intact.; ORNT1). Mutations in the mitochondrial ornithine transporter result in hyperammonemia, hyperornithinemia, homocitrullinuria (HHH) syndrome, a disorder of the urea cycle. (PMID 16256388) The pathophysiology of the disease may involve diminished ornithine transport into mitochondria, resulting in ornithine accumulation in the cytoplasm and reduced ability to clear carbamoyl phosphate and ammonia loads. (OMIM 838970); Ornithine is an amino acid produced in the urea cycle by the splitting off of urea from arginine. It is a central part of the urea cycle, which allows for the disposal of excess nitrogen. L-Ornithine is also a precursor of citrulline and arginine. In order for ornithine produced in the cytosol to be converted to citrulline, it must first cross the inner mitochondrial membrane into the mitochondrial matrix where it is carbamylated by ornithine transcarbamylase. This transfer is mediated by the mitochondrial ornithine transporter (SLC25A15; Ornithine is an amino acid which plays a role in the urea cycle. Ornithine is found in many foods, some of which are soft-necked garlic, orange bell pepper, sunburst squash (pattypan squash), and cucumber. L-Ornithine hydrochloride is a non-proteinogenic amino acid, is mainly used in urea cycle removing excess nitrogen in vivo. L-Ornithine hydrochloride shows nephroprotective[1][2].
2-(3-Hydroxy-4-methoxyphenyl)ethanaminium
C9H14NO2+ (168.10244840000001)
(2E)-2-butylidene-4-hydroxy-5-methyl-3(2H)-furanone
1-(3,4-Dihydroxyphenyl)propan-2-ylazanium
C9H14NO2+ (168.10244840000001)
[(1R)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]azanium
C9H14NO2+ (168.10244840000001)
Pyridoxal(1+)
A pyridinium ion obtained by protonation of the ring nitrogen of pyridoxal. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3-[(Z)-2-isocyanovinyl]indole
A 3-(2-isocyanovinyl)indole in which the double bond of the isocyanovinyl group has Z (cis-) configuration. An antibacterial agent isolated from a species of Pseudomonas.
3-methoxytyraminium
A primary ammonium ion that is the conjugate acid of 3-methoxytyramine resulting from the protonation of the primary amino group; Major microspecies at pH 7.3.
Hexamethylene diisocyanate
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D003432 - Cross-Linking Reagents D004785 - Environmental Pollutants > D000393 - Air Pollutants
beta-Carboline
The parent compound of the beta-carbolines, a tricyclic structure comprising an indole ring system ortho- fused to C-3 and C-4 of a pyridine ring.
4-methoxytyraminium
A primary ammonium ion that is the conjugate acid of 4-methoxytyramine resulting from the protonation of the primary amino group; major microspecies at pH 7.3.
D-synephrine(1+)
An organic cation that is the conjugate acid of D-synephrine, arising from protonation of the secondary amino group; major species at pH 7.3.
D-Ornithine hydrochloride
D-Ornithine ((R)-Ornithine) hydrochloride is an endogenous metabolite. D-Ornithine ((R)-Ornithine) hydrochloride is an endogenous metabolite. D-Ornithine, hydrochloride (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=16682-12-5 (retrieved 2024-08-19) (CAS RN: 16682-12-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
n-(1-hydroxybut-2-en-1-ylidene)but-2-enehydrazonic acid
(2r)-2-hydroxy-2,4-dimethyl-5-[(1e)-prop-1-en-1-yl]furan-3-one
1-hydroxy-8-methyl-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one
[(3as,4s,6ar)-5-(hydroxymethyl)-3ah,4h,6ah-cyclopenta[b]furan-4-yl]methanol
2-hydroxy-2,4-dimethyl-5-[(1e)-prop-1-en-1-yl]furan-3-one
[5-(hydroxymethyl)-3ah,4h,6ah-cyclopenta[b]furan-4-yl]methanol
1-(2-propenyl)-naphthalene
{"Ingredient_id": "HBIN000965","Ingredient_name": "1-(2-propenyl)-naphthalene","Alias": "NA","Ingredient_formula": "C13H12","Ingredient_Smile": "C=CCC1=CC=CC2=CC=CC=C21","Ingredient_weight": "168.23 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34142","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "17217","DrugBank_id": "NA"}
2,5-dihydroxybenzyl alcohol,8ci; 2-et ether
{"Ingredient_id": "HBIN004633","Ingredient_name": "2,5-dihydroxybenzyl alcohol,8ci; 2-et ether","Alias": "NA","Ingredient_formula": "C9H12O3","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8854","PubChem_id": "NA","DrugBank_id": "NA"}
(4aR,7aS)-7-methylol-4,4a,5,7a-tetrahydro-3H-cyclopenta[c]pyran-1-one
{"Ingredient_id": "HBIN010231","Ingredient_name": "(4aR,7aS)-7-methylol-4,4a,5,7a-tetrahydro-3H-cyclopenta[c]pyran-1-one","Alias": "(4aR,7aS)-7-(hydroxymethyl)-4,4a,5,7a-tetrahydro-3H-cyclopenta[c]pyran-1-one","Ingredient_formula": "C9H12O3","Ingredient_Smile": "NA","Ingredient_weight": "168.19","OB_score": "82.28297774","CAS_id": "170384-80-2","SymMap_id": "SMIT10673","TCMID_id": "NA","TCMSP_id": "MOL009556","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}