Exact Mass: 192.076
Exact Mass Matches: 192.076
Found 500 metabolites which its exact mass value is equals to given mass value 192.076,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Quinic acid
Quinic acid, also known as quinate, belongs to the class of organic compounds known as quinic acids and derivatives. Quinic acids and derivatives are compounds containing a quinic acid moiety (or a derivative thereof), which is a cyclitol made up of a cyclohexane ring that bears four hydroxyl groups at positions 1,3, 4, and 5, as well as a carboxylic acid at position 1. Quinic acid is a sugar acid. It is also a cyclitol, or cyclic polyol. More specifically, quinic acid is a crystalline acid obtained from cinchona bark, coffee beans, tobacco leaves, carrot leaves, apples, peaches, pears, plums, vegetables, etc. Quinic acid can also be made synthetically by hydrolysis of chlorogenic acid. Quinic acid is implicated in the perceived acidity of coffee. (-)-quinic acid is the (-)-enantiomer of quinic acid. It is a conjugate acid of a (-)-quinate. It is an enantiomer of a (+)-quinic acid. Quinate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Quinic acid is a natural product found in Gamblea innovans, Pterocaulon virgatum, and other organisms with data available. An acid which is found in cinchona bark and elsewhere in plants. (From Stedman, 26th ed) Quinic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=36413-60-2 (retrieved 2024-07-01) (CAS RN: 36413-60-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee. D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee.
Myristicin
Myristicin is an organic molecular entity. It has a role as a metabolite. Myristicin is a natural product found in Chaerophyllum azoricum, Peperomia bracteata, and other organisms with data available. Myristicin is found in anise. Myristicin is a constituent of dill, nutmeg, parsley and many other essential oils. May be responsible for psychotic effects of nutmeg at large doses Myristicin, 3-methoxy,4,5-methylendioxy-allylbenzene, is a natural organic compound present in the essential oil of nutmeg and to a lesser extent in other spices such as parsley and dill. Myristicin is a naturally occurring insecticide and acaricide with possible neurotoxic effects on dopaminergic neurons[citation needed]. It has hallucinogenic properties at doses much higher than used in cooking. Myristicin is a weak inhibitor of monoamine oxidase.Myristicin has been shown to exhibit apoptotic and hepatoprotective functions (A7836, A7837).Myristicin belongs to the family of Benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Myristicin is found in anise. Myristicin is a constituent of dill, nutmeg, parsley and many other essential oils. May be responsible for psychotic effects of nutmeg at large doses Myristicin, 3-methoxy,4,5-methylendioxy-allylbenzene, is a natural organic compound present in the essential oil of nutmeg and to a lesser extent in other spices such as parsley and dill. Myristicin is a naturally occurring insecticide and acaricide with possible neurotoxic effects on dopaminergic neurons[citation needed]. It has hallucinogenic properties at doses much higher than used in cooking. Myristicin is a weak inhibitor of monoamine oxidase Constituent of dill, nutmeg, parsley and many other essential oils. May be responsible for psychotic effects of nutmeg at large doses Myristicine ?act as a serotonin receptor antagonist, a weak monamine oxidase (MAO) inhibitor. Myristicine is the main component of nutmeg essential oil from Myristica fragrans?Houtt. Myristicine abuse produce hallucinogenic effects, organ damage, deliriumand others[1]. Myristicine is an orally bioavailable serotonin receptor antagonist and weak monoamine oxidase (MAO) inhibitor. Myristicine also exerts anti-cancer effects on gastric cancer cells by inhibiting the EGFR/ERK signaling pathway. Myristicine is the main component of nutmeg essential oil and has anti-cancer, anti-proliferative, antibacterial, anti-inflammatory and apoptosis-inducing effects. Myristicine abuse can produce hallucinogenic effects, organ damage, etc[1][2][3][4]. Myristicine is an orally bioavailable serotonin receptor antagonist and weak monoamine oxidase (MAO) inhibitor. Myristicine also exerts anti-cancer effects on gastric cancer cells by inhibiting the EGFR/ERK signaling pathway. Myristicine is the main component of nutmeg essential oil and has anti-cancer, anti-proliferative, antibacterial, anti-inflammatory and apoptosis-inducing effects. Myristicine abuse can produce hallucinogenic effects, organ damage, etc[1][2][3][4]. Myristicine ?act as a serotonin receptor antagonist, a weak monamine oxidase (MAO) inhibitor. Myristicine is the main component of nutmeg essential oil from Myristica fragrans?Houtt. Myristicine abuse produce hallucinogenic effects, organ damage, deliriumand others[1].
Isoshinanolone
Isoshinanolone is a member of tetralins. Isoshinanolone is a natural product found in Ancistrocladus heyneanus, Dioncophyllum thollonii, and other organisms with data available.
5-methoxy-6-(2-propenyl)-1,3-benzodioxole
Flavouring compound [Flavornet]
cis-1,2-Dihydroxy-1,2-dihydro-7-hydroxymethylnaphthalene
Dehydrozingerone
Dehydrozingerone is a flavouring ingredien Flavouring ingredient
trans-Coumaryl acetate
A phenylpropanoid that is trans-p-coumaryl alcohol in which the hydrogen from the allylic hydroxy group is replaced by an acetyl group.
2-Epi-5-epi-valiolone
A member of the class of cyclitols that is valiolone in which the stererocentres at positions 2 and 5 have been inverted.
5-Epi-valiolone
A member of the class of cyclitols that is valiolone in which the stererocentre at position 5 has been inverted.
2-epi-Valiolone
A cyclitol that is valiolone in which the the stereochemistry at position 2 has been inverted (from R to S).
Oxoamide
Oxoamide is a metabolite of Cotinine, which is a major metabolite of Nicotine. A metabolite of Cotinine, which is a major metabolite of Nicotine. [HMDB]
Hydroxycotinine
Quantitatively, the most important metabolite of nicotine in most mammalian species is cotinine. In humans, about 70 to 80\\\% of nicotine is converted to cotinine. 3-Hydroxycotinine (3HC) is the main nicotine metabolite detected in smokers urine. It is also excreted as a glucuronide conjugate (3HC-Gluc). 3HC and 3HC-Gluc account for 40-60\\\% of the nicotine dose in urine. [HMDB] Quantitatively, the most important metabolite of nicotine in most mammalian species is cotinine. In humans, about 70 to 80\\\% of nicotine is converted to cotinine. 3-Hydroxycotinine (3HC) is the main nicotine metabolite detected in smokers urine. It is also excreted as a glucuronide conjugate (3HC-Gluc). 3HC and 3HC-Gluc account for 40-60\\\% of the nicotine dose in urine. Hydroxycotinine is the main nicotine metabolite detected in smokers urine.
Cotinine N-oxide
Cotinine N-oxide is a minor metabolite of nicotine, cotinine formation being the major pathway of nicotine metabolism in smokers. Cotinine N-oxide accounts for less than 5\\% of the nicotine dose. Cotinine N-oxide can be reduced back to the parent amine in vivo. Nicotine is a naturally occurring alkaloid found in many plants. The principal sources of nicotine exposure are through the use of tobacco, nicotine containing gum and nicotine replacement therapies. Nicotine is an amine composed of pyridine and pyrrolidine rings. It has been shown that nicotine crosses biological membranes and the blood brain barrier easily. The absorbed nicotine is extensively metabolized in the liver to form a wide variety of metabolites including and cotinine N-oxide. Nicotine has been shown to affect a wide variety of biological functions ranging from gene expression, regulation of hormone secretion and enzyme activities. (PMID: 16359169, 15109883) [HMDB] Cotinine N-oxide is a minor metabolite of nicotine, cotinine formation being the major pathway of nicotine metabolism in smokers. Cotinine N-oxide accounts for less than 5\\% of the nicotine dose. Cotinine N-oxide can be reduced back to the parent amine in vivo. Nicotine is a naturally occurring alkaloid found in many plants. The principal sources of nicotine exposure are through the use of tobacco, nicotine containing gum and nicotine replacement therapies. Nicotine is an amine composed of pyridine and pyrrolidine rings. It has been shown that nicotine crosses biological membranes and the blood brain barrier easily. The absorbed nicotine is extensively metabolized in the liver to form a wide variety of metabolites including and cotinine N-oxide. Nicotine has been shown to affect a wide variety of biological functions ranging from gene expression, regulation of hormone secretion and enzyme activities. (PMID: 16359169, 15109883).
1'-Hydroxychavicol acetate
1-Hydroxychavicol acetate is found in herbs and spices. 1-Hydroxychavicol acetate is a constituent of Alpinia galanga (greater galangal). Constituent of Alpinia galanga (greater galangal). 1-Hydroxychavicol acetate is found in herbs and spices.
Isomyristicin
Isomyristicin is found in dill. Isomyristicin is found in dill, parsley and nutmeg oils. Found in dill, parsley and nutmeg oils
Methyl trans-p-methoxycinnamate
Methyl trans-p-methoxycinnamate is found in herbs and spices. Methyl trans-p-methoxycinnamate is isolated from Kaempferia galanga (galangal
(R)-Shinanolone
(R)-Shinanolone is found in fruits. (R)-Shinanolone is isolated from Diospyros kaki (Japanese persimmon
Serylserine
Serylserine is a dipeptide composed of two serine residues. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
N'-Hydroxymethylnorcotinine
N-Hydroxymethylnorcotinine is a cotinine metabolite derived from liver. Formation of norcotinine via N-demethylation of cotinine is expected to proceed via the N-hydroxymethyl intermediate, which is predicted to be relatively stable, due to the low pKa of the pyrrolidone-N moiety.
5'-Hydroxycotinine
A hydroxylated derivative of cotinine. Cotinine is dervied from nicotine. [HMDB]. 5-Hydroxycotinine is found in many foods, some of which are shiitake, sweet cherry, moth bean, and blackcurrant. 5-Hydroxycotinine is a hydroxylated derivative of cotinine. Cotinine is dervied from nicotine.
Allyl phenoxyacetate
Allyl phenoxyacetate is a flavouring ingredien Flavouring ingredient
Ethyl phenylglycidate
Ethyl 3-phenylglycidate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") Flavouring ingredient
(Z)-4-Methoxy-6-(1-propenyl)-1,3-benzodioxole
(Z)-4-Methoxy-6-(1-propenyl)-1,3-benzodioxole is found in herbs and spices. (Z)-4-Methoxy-6-(1-propenyl)-1,3-benzodioxole is present in nutmeg (Myristica fragrans Present in nutmeg (Myristica fragrans). (Z)-4-Methoxy-6-(1-propenyl)-1,3-benzodioxole is found in herbs and spices.
Isoeugenol formate
Isoeugenol formate is a flavouring ingredient. Flavouring ingredient
Eugenyl formate
Eugenyl formate is a flavouring ingredient. Flavouring ingredient
Ethyl 3-oxo-3-phenylpropanoate
Ethyl 3-oxo-3-phenylpropanoate is a flavouring ingredient. Flavouring ingredient
Benzyl acetoacetate
Benzyl acetoacetate is a flavouring ingredient. Flavouring ingredient
4-(3,4-Methylenedioxyphenyl)-2-butanone
4-(3,4-Methylenedioxyphenyl)-2-butanone is used in food flavouring. It is used in food flavouring
Propan-2-yl 2-hydroxy-4-methylsulfanylbutanoate
2,3,5,6-Tetramethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione
10-Hydroxy-2-oxabicyclo[6.2.2]dodeca-1(10),8,11-trien-3-one
Isopropyl tartaric acid
Isopropyl tartaric acid belongs to beta hydroxy acids and derivatives class of compounds. Those are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom. Isopropyl tartaric acid is soluble (in water) and a weakly acidic compound (based on its pKa). Isopropyl tartaric acid can be found in oat, which makes isopropyl tartaric acid a potential biomarker for the consumption of this food product.
Dihydrobenzofuran
Dihydrobenzofuran, also known as ethyl 2,3-dihydrobenzofuran-2-carboxylate, is a member of the class of compounds known as coumarans. Coumarans are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring. Dihydrobenzofuran is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Dihydrobenzofuran can be found in fenugreek, which makes dihydrobenzofuran a potential biomarker for the consumption of this food product.
coumaryl acetate
Coumaryl acetate is also known as coumaryl acetic acid. Coumaryl acetate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Coumaryl acetate can be found in a number of food items such as tinda, babassu palm, german camomile, and hard wheat, which makes coumaryl acetate a potential biomarker for the consumption of these food products.
trans-3'-hydroxycotinine
Trans-3-hydroxycotinine, also known as 1-methyl-3-hydroxy-5-(3-pyridyl)-2-pyrrolidinone, is a member of the class of compounds known as pyrrolidinylpyridines. Pyrrolidinylpyridines are compounds containing a pyrrolidinylpyridine ring system, which consists of a pyrrolidine ring linked to a pyridine ring. Trans-3-hydroxycotinine is soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-3-hydroxycotinine can be found in a number of food items such as annual wild rice, macadamia nut, corn salad, and radish, which makes trans-3-hydroxycotinine a potential biomarker for the consumption of these food products.
3,4,-Dihydro-6-hydroxy-4,7-dimethyl-2H-1-benzopyran-2-one
Quinic acid
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.054 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.053 D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee. D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee.
5-hydroxy-4-methoxy-3,4-dihydro-2H-naphthalen-1-one
(3S*,4S*)-3,4-dihydroxy-7-methyl-3,4-dihydro-1(2H)-naphthalenone
(-)-(1S,2R,5S,6R)-asperpentyn|(-)-Asperpentyn|(1R,2R,3S,4S)-2,3-Epoxy-6-(3-methylbut-3-en-1-ynyl)-5-cyclohexen-1,4-diol|aspepentyn
(2S,4S)-4,8-dihydroxy-2-methyl-3,4-dihydronaphthalen-1(2H)-one|isoplumbagolone
Me ester-(S,Z)-8-Hydroxy-2-decene-4,6-diynoic acid
10-Hydroxy-dec-2t-en-4,6-diinsaeure-methylester|10-hydroxy-dec-2t-ene-4,6-diynoic acid methyl ester
3,4-Dihydro-4,5-dihydroxy-2-methyl-1(2H)-naphthalenone
4-hydroxy-3-methyl-6-((E,E)-1,3-pentadienyl)-2H-pyran-2-one|trichopyrone
Methyl 2-methyl-2,3-dihydrobenzofuran-7-carboxylate
1,3-O-(1-Carboxy-aethyliden)-L-erythrit|1,3-O-<1-Carboxy-aethyliden>-L-erythrit
Me glycoside,Me ester-beta-D-Furanose-Riburonic acid
3-hydroxy-1-methyl-5-pyridin-3-yl-pyrrolidin-2-one|Hydroxy-cotinin
2-Acetyl-3-hydroxy-5-methyl-6,7-dihydro-5H-cyclopentapyrazin
b-D-altro-2-Heptulopyranose,2,7-anhydro-
4-Oxo-N-methyl-4--butyramid|gamma-<3-Pyridyl>-beta-oxo-N-methylbutyramid|N-methyl-3-oxo-4-pyridin-3-yl-butyramide
ethyl coumarate
Ethyl p-coumarate is a cinnamate ester. (E)-Ethyl 3-(4-hydroxyphenyl)acrylate is a natural product found in Apis with data available. p-Coumaric Acid Ethyl Ester is the ethyl ester of p-Coumaric acid[1]. p-Coumaric Acid is a potential immunosuppressive agent in treating autoimmune inflammatory diseases like rheumatoid arthritis[1]. p-Coumaric Acid Ethyl Ester is the ethyl ester of p-Coumaric acid[1]. p-Coumaric Acid is a potential immunosuppressive agent in treating autoimmune inflammatory diseases like rheumatoid arthritis[1].
1,3-Dimethylpteridine-2,4-dione
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3104
D-(-)-Quinic acid
D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee. D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee.
(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid
(1S,3R,4S,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid
Hydroxycotinine
CONFIDENCE standard compound; INTERNAL_ID 2275 Hydroxycotinine is the main nicotine metabolite detected in smokers urine.
Cotinine N-oxide
An N-alkylpyrrolidine that is nicotine in which the methylene hydrogens at position 2 on the pyrrolidine ring have been replaced by an oxo group and the pyridine nitrogen converted into the corresponding N-oxide. A minor metabolite of nicotine.
ETHYL-p-COUMARATE
p-Coumaric Acid Ethyl Ester is the ethyl ester of p-Coumaric acid[1]. p-Coumaric Acid is a potential immunosuppressive agent in treating autoimmune inflammatory diseases like rheumatoid arthritis[1]. p-Coumaric Acid Ethyl Ester is the ethyl ester of p-Coumaric acid[1]. p-Coumaric Acid is a potential immunosuppressive agent in treating autoimmune inflammatory diseases like rheumatoid arthritis[1].
(2E)-2-[(2Z)-2-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)ETHYLIDENE]-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE
4H-1,3-Benzodioxin-7-carboxaldehyde,2,2-dimethyl-(9CI)
5-hydroxy-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylic acid
Urea, (2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)- (9CI)
7-hydroxy-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
2-amino-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
2H-Benzimidazole-2-thione,1,3-dihydro-1-(1-methylethyl)-(9CI)
2-(Trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[1,5-a]pyrazine
1H-Benzimidazole-1-carboxylicacid,2,3-dihydro-2-oxo-,hydrazide(9CI)
1-(2,3-DIHYDROBENZO[B][1,4]DIOXIN-6-YL)PROPAN-2-ONE
Pyrazolo[1,5-a]pyrimidine-6-carboxylic acid, 7-amino-3-methyl- (7CI)
2-AMINO-6-METHYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE
(1R,2S)-2-(hydroxymethyl)-1-phenylcyclopropane-1-carboxylic acid
(4,5-DICHLORO-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL)METHYL2-CHLORO-6-FLUOROBENZOATE
5-(4-Fluoro-phenyl)-1-methyl-1,2-dihydropyrazol-3-one
2-hydroxyethyl-tris(trideuteriomethyl)azanium,bromide
1-(2,2,2-TRIFLUOROACETYL)-4-PIPERIDINECARBOXYLICACID
7-Amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
4H-1,3-Benzodioxin-6-carboxaldehyde,2,2-dimethyl-(9CI)
2,5-Dihydro-3-methyl-1-phenyl-1H-phosphole 1-oxide
4,9-dihydrodipyrazolo[1,3-b:1,3-e]pyrazine-4,9-diol
2,7-dimethyl-2,3-dihydro-1-benzofuran-6-carboxylic acid
Ethyl 4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
2-NAPHTHALENECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-6-HYDROXY-
5-(aminomethyl)-4-(trifluoromethyl)pyrimidin-2-amine
2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
2-AMINO-[1,2,4]TRIAZOLO[1,5-A]PYRIDINE-6-CARBOXYLIC ACID METHYL ESTER
5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-carbaldehyde
1H-Benzimidazole-2-carboxaldehyde,1-ethyl-5-fluoro-(9CI)
methyl 6-hydroxy-2,3-dihydro-1H-indene-1-carboxylate
8-hydroxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
1H-Benzimidazole,1-methyl-2-[(methylthio)methyl]-(9CI)
7-HYDROXY-1,2,3,4-TETRAHYDRO-NAPHTHALENE-2-CARBOXYLIC ACID
6-Amino-2-azaspiro[3.3]heptane-6-carboxylic acid HCl
2-(HYDROXY-PHENYL-METHYL)-ACRYLIC ACID METHYL ESTER
1-(4-FLUORO-PHENYL)-5-OXO-PYRROLIDINE-3-CARBOXYLICACID
4,7-dimethylpyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid
N-(4-Oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl)acetamide
1-(3,6-DIBROMO-CARBAZOL-9-YL)-3-[4-(4-FLUORO-PHENYL)-PIPERAZIN-1-YL]-PROPAN-2-OL
5-(aminomethyl)-2-(trifluoromethyl)pyrimidin-4-amine
1-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)ETHAN-1-ONE
4-(2-amino-1,2,2-trideuterio-1-hydroxyethyl)phenol,hydrochloride
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
1-NAPHTHALENECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-6-HYDROXY-
(1R,2R)-2-(Hydroxymethyl)-1-phenylcyclopropanecarboxylic acid
1H-Benzimidazole-2-methanol,1-(methoxymethyl)-(9CI)
2-Hydroxy-3-(2-propen-1-yl)benzoic acid methyl ester
8-Hydroxy-3,7-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one
2-Pyrrolidinone, 3-hydroxy-1-methyl-5-(3-pyridinyl)-
(2R,3R)-2,3-Dihydroxy-4-oxo-4-[(propan-2-yl)oxy]butanoic acid
5-ethyl-4,6-dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile
(2S,3S,4R,5R)-6-(Hydroxyamino)-2-(hydroxymethyl)-2,3,4,5-tetrahydropyridine-3,4,5-triol
(2E,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-(hydroxymethyl)-2-piperidinone
Myristicin
Myristicine ?act as a serotonin receptor antagonist, a weak monamine oxidase (MAO) inhibitor. Myristicine is the main component of nutmeg essential oil from Myristica fragrans?Houtt. Myristicine abuse produce hallucinogenic effects, organ damage, deliriumand others[1]. Myristicine is an orally bioavailable serotonin receptor antagonist and weak monoamine oxidase (MAO) inhibitor. Myristicine also exerts anti-cancer effects on gastric cancer cells by inhibiting the EGFR/ERK signaling pathway. Myristicine is the main component of nutmeg essential oil and has anti-cancer, anti-proliferative, antibacterial, anti-inflammatory and apoptosis-inducing effects. Myristicine abuse can produce hallucinogenic effects, organ damage, etc[1][2][3][4]. Myristicine is an orally bioavailable serotonin receptor antagonist and weak monoamine oxidase (MAO) inhibitor. Myristicine also exerts anti-cancer effects on gastric cancer cells by inhibiting the EGFR/ERK signaling pathway. Myristicine is the main component of nutmeg essential oil and has anti-cancer, anti-proliferative, antibacterial, anti-inflammatory and apoptosis-inducing effects. Myristicine abuse can produce hallucinogenic effects, organ damage, etc[1][2][3][4]. Myristicine ?act as a serotonin receptor antagonist, a weak monamine oxidase (MAO) inhibitor. Myristicine is the main component of nutmeg essential oil from Myristica fragrans?Houtt. Myristicine abuse produce hallucinogenic effects, organ damage, deliriumand others[1].
(+)-Quinic acid
The (+)-enantiomer of quinic acid.
Daedalin A
A chromenol that is 2H-chromen-6-ol substituted at position 2 by a hydroxymethyl and a methyl group ( the 2R stereoisomer). Isolated from the mycelial culture broth of Daedalea dickinsii, it exhibits tyrosinase inhibitory and radical scavenging activities.
N(6)-carbamoylmethyladenine
A nucleobase analogue that is adenine in which one of the exocyclic amino hydrogens is replaced by a carbamoylmethyl group.
N-hydroxydihomomethioninate
Conjugate base of N-hydroxydihomomethionine.
2,2-Dimethyl-1a,7b-dihydrooxireno[2,3-c]chromen-7-ol
1H-Pyrrolo[2,1-f]purine-2,4(3H,6H)-dione, 7,8-dihydro-
Quinic_acid
(-)-quinic acid is the (-)-enantiomer of quinic acid. It is a conjugate acid of a (-)-quinate. It is an enantiomer of a (+)-quinic acid. Quinate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Quinic acid is a natural product found in Gamblea innovans, Pterocaulon virgatum, and other organisms with data available. An acid which is found in cinchona bark and elsewhere in plants. (From Stedman, 26th ed) D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee. D-(-)-Quinic acid is a cyclohexanecarboxylic acid and is implicated in the perceived acidity of coffee.
trans-3-Hydroxycotinine
An N-alkylpyrrolidine that is cotinine substituted at position C-3 by a hydroxy group (the 3R,5S-diastereomer).
7-methylmellein
An isochromane that is mellein bearing an additional methyl substituent at position 7.
phenylacetylglycine(1-)
A monocarboxylic acid anion obtained by removal of a proton from the carboxylic acid group of phenylacetylglycine. The major species of phenylacetylglycine at pH 7.3.
5-hydroxy-4-(hydroxymethyl)-2-methyl-1,3-dioxane-2-carboxylic acid
(2r)-5-methoxy-2-methyl-2,3-dihydro-1-benzopyran-4-one
5-hydroxy-7-(prop-2-en-1-yl)-2h,7h,7ah-cyclopenta[b]pyran-6-one
(3r,4s)-3,4-dihydroxy-7-methyl-3,4-dihydro-2h-naphthalen-1-one
(1s,9s)-5-hydroxy-7,11-diazatricyclo[7.2.1.0²,⁷]dodeca-2,4-dien-6-one
(4s)-5-hydroxy-4-methoxy-3,4-dihydro-2h-naphthalen-1-one
3-(3-methylbut-3-en-1-yn-1-yl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol
(3r,4s)-4,8-dihydroxy-3-methyl-3,4-dihydro-2h-naphthalen-1-one
3-(4-hydroxyphenyl)-2-propenoic acid,9ci; (e)-form,me ether,me ester
{"Ingredient_id": "HBIN007483","Ingredient_name": "3-(4-hydroxyphenyl)-2-propenoic acid,9ci; (e)-form,me ether,me ester","Alias": "NA","Ingredient_formula": "C11H12O3","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "3901/7/3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8484","PubChem_id": "NA","DrugBank_id": "NA"}
(4r)-5-hydroxy-4-methoxy-α-tetralone
{"Ingredient_id": "HBIN010865","Ingredient_name": "(4r)-5-hydroxy-4-methoxy-\u03b1-tetralone","Alias": "NA","Ingredient_formula": "C11H12O3","Ingredient_Smile": "COC1CCC(=O)C2=C1C(=CC=C2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10460","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(?)-5-hydroxy-4-methoxy-1-tetralone
{"Ingredient_id": "HBIN011614","Ingredient_name": "(?)-5-hydroxy-4-methoxy-1-tetralone","Alias": "NA","Ingredient_formula": "C11H12O3","Ingredient_Smile": "COC1CCC(=O)C2=C1C(=CC=C2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10459","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anticancer benzenoid pmv70p691-57
{"Ingredient_id": "HBIN016310","Ingredient_name": "anticancer benzenoid pmv70p691-57","Alias": "NA","Ingredient_formula": "C11H12O3","Ingredient_Smile": "COC1=C(C=C(C=C1)C=CC=O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1385","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
