Exact Mass: 125.9884

Exact Mass Matches: 125.9884

Found 230 metabolites which its exact mass value is equals to given mass value 125.9884, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

1,2,3-Trihydroxybenzene

2,3-Dihydroxyphenol; Benzene-1,2,3-triol; NSC 5035

C6H6O3 (126.0317)


1,2,3-trihydroxybenzene, also known as pyrogallic acid or 1,2,3-benzenetriol, is a member of the class of compounds known as 5-unsubstituted pyrrogallols. 5-unsubstituted pyrrogallols are pyrrogallols that are unsubstituted at th5-position of the benzene ring. 1,2,3-trihydroxybenzene is soluble (in water) and a very weakly acidic compound (based on its pKa). 1,2,3-trihydroxybenzene can be found in arabica coffee, beer, cocoa powder, and coffee, which makes 1,2,3-trihydroxybenzene a potential biomarker for the consumption of these food products. 1,2,3-trihydroxybenzene can be found primarily in blood, feces, and urine. 1,2,3-trihydroxybenzene is an organic compound with the formula C6H3(OH)3. It is a white water-soluble solid although samples are typically brownish because of its sensitivity toward oxygen. It is one of three isomeric benzenetriols . Pyrogallic acid is an odorless white to gray solid. Sinks and mixes with water. (USCG, 1999) Pyrogallol is a benzenetriol carrying hydroxy groups at positions 1, 2 and 3. It has a role as a plant metabolite. It is a phenolic donor and a benzenetriol. Pyrogallol is a natural product found in Gunnera perpensa, Nigella glandulifera, and other organisms with data available. A trihydroxybenzene or dihydroxy phenol that can be prepared by heating GALLIC ACID. See also: Stevia rebaudiuna Leaf (part of); Alchemilla monticola whole (part of); Agrimonia eupatoria flowering top (part of). 1,2,3-Trihydroxybenzene, or pyrogallol is a benzenetriol. It is a white crystalline powder and a powerful reducing agent. It was first prepared by Scheele 1786 by heating gallic acid. An alternate preparation is heating para-chlorophenoldisulphonic acid with potassium hydroxide. 1,2,3-Trihydroxybenzene has been found to be a metabolite of Aspergillus (https://www.tandfonline.com/doi/pdf/10.1080/00021369.1982.10865473). A benzenetriol carrying hydroxy groups at positions 1, 2 and 3. D020011 - Protective Agents > D000975 - Antioxidants Pyrogallol is a polyphenol compound, which has anti-fungal and anti-psoriatic properties. Pyrogallol is a reductant that is able to generate free radicals, in particular superoxide anions. Pyrogallol is a polyphenol compound, which has anti-fungal and anti-psoriatic properties. Pyrogallol is a reductant that is able to generate free radicals, in particular superoxide anions.

   

Dimethyl trisulfide

FLAMMABLE LIQUID, N.O.S. (DIMETHYL TRISULPHIDE)

C2H6S3 (125.9632)


Dimethyl trisulfide (DMTS) is an organic chemical compound and the simplest organic trisulfide. It is a flammable liquid with a foul odor, which is detectable at levels as low as 1 part per trillion. Dimethyl trisulfide has been found in volatiles emitted from cooked onion, leek and other Allium species, from broccoli and cabbage, as well as from Limburger cheese, and is involved in the unpalatable aroma of aged beer and stale Japanese sake. It is a decomposition product from bacterial decomposition, including from the early stages of human decomposition, and is a major attractant for blowflies looking for hosts. Dimethyl trisulfide along with dimethyl sulfide and dimethyl disulfide have been confirmed as volatile compounds given off by the fly-attracting plant known as dead-horse arum (Helicodiceros muscivorus). These flies are attracted to the odor of fetid meat and help pollinate this plant. DMTS contributes to the foul odor given off by the fungus Phallus impudicus, also known as the common stinkhorn. DMTS causes the characteristic malodorous smell of a fungating lesion, e.g., from cancer wounds, and contributes to the odor of human feces. Dimethyldisulfide is a volatile organic compound. Methyl disulfide is occasionally found as a volatile component of normal human breath and biofluids. Dimethyldisulfide is one of the representative volatile components found in oral malodor. Dimethyldisulfide concentrations in breath is a practical noninvasive way to assess recent exposure to sulfur compounds in sulfate pulp mills, and therefore it should be applicable to workplaces contaminated. (PMID: 5556886, 14691119, 11236158, 8481097) (Wikipedia). Found in essential oil of hop (Humulus lupulus), garlic (Allium sativum), shallot (Allium cepa) and ramsons (Allium ursinum)and is also found in pineapple, raw cabbage, kohrabi, roasted filberts, roasted peanuts, edible mushrooms, brussel sprouts, fermented radish, Chinese cabbage, parsnips, scallop and squid. The major off-flavour principle of overcooked brassicas. Flavouring ingredient. Dimethyl trisulfide is an organic trisulfide. Dimethyl trisulfide is a natural product found in Psidium guajava, Allium chinense, and other organisms with data available. dimethyltrisulfide is a metabolite found in or produced by Saccharomyces cerevisiae. Dimethyl trisulfide is an organic chemical compound and the simplest organic trisulfide found in garlic, onion, broccoli, and similar plants. Dimethyl trisulfide is a cyanide antidote[1]. Dimethyl trisulfide is an organic chemical compound and the simplest organic trisulfide found in garlic, onion, broccoli, and similar plants. Dimethyl trisulfide is a cyanide antidote[1].

   

2-Hydroxyethanesulfonate

2-HYDROXYETHANESULPHONIC ACID (80\\% IN WATER)

C2H6O4S (125.9987)


2-Hydroxyethanesulfonate (also known as 2-Hydroxyethanesulfonic acid or isethionic acid) is an organosulfur compound containing a short chain alkane sulfonate linked to a hydroxyl group. It is a water-soluble liquid used in the manufacture of mild, biodegradable, and high-foaming anionic surfactants. These surfactants provide gentle cleansing and a soft skin feel. 2-Hydroxyethanesulfonate forms a colourless, syrupy, and strongly acidic liquid that can form detergents with oleic acid. 2-Hydroxyethanesulfonate is frequently used in the industrial production of taurine. Mammals are also able to endogenously synthesize 2-hydroxyethanesulfonate via taurine through a possible enzymatic deamination process (PMID: 14490797). 2-Hydroxyethanesulfonate can be found in both human plasma and urine (PMID: 1159536, PMID: 6066118). Higher plasma levels of 2-hydroxyethanesulfonate have been shown to be protective against type 2 diabetes. Isethionic acid is an alkanesulfonic acid in which the sulfo group is directly linked to a 2-hydroxyethyl group. It has a role as a human metabolite. It is a conjugate acid of an isethionate. Isethionic acid is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). 2-Hydroxyethanesulfonic acid is a natural product found in Gayliella flaccida, Tichocarpus crinitus, and Trypanosoma brucei with data available. A colorless, syrupy, strongly acidic liquid that can form detergents with oleic acid. Isethionic acid C2H6O4S is a short chain alkane sulfonate containing hydroxy group, is a water soluble liquid used in the manufacture of mild, biodegradable and high foaming anionic surfactants which provides gentle cleansing and soft skin feel. An alkanesulfonic acid in which the sulfo group is directly linked to a 2-hydroxyethyl group. KEIO_ID I041

   

triacetate lactone

2-Hydroxy-6-methyl-4H-pyran-4-one

C6H6O3 (126.0317)


   

Maltol

3-Hydroxy-2-methyl-4-pyrone; 3-Hydroxy-2-methyl-pyran-4-one; Maltol; Deferiprone Impurity B

C6H6O3 (126.0317)


Maltol, also known as E636 or fema 2656, belongs to the class of organic compounds known as pyranones and derivatives. Pyranones and derivatives are compounds containing a pyran ring which bears a ketone. Some synthetic derivatives of maltol, developed at the University of Urbino, showed limited in vitro antiproliferative activity towards cancer cells lines, perhaps inducing apoptosis in these cells. Maltol is a sweet, baked, and bread tasting compound. Maltol has been detected, but not quantified, in several different foods, such as milk and milk products, nuts, soy beans, pepper (c. annuum), and coffee and coffee products. Maltols sweetness adds to the odor of freshly baked bread, and is used as a flavor enhancer (INS Number 636) in breads and cakes. Related to this property, maltol has been reported to greatly increase aluminum uptake in the body and to increase the oral bioavailability of gallium and iron. Maltol is a naturally occurring organic compound that is used primarily as a flavor enhancer. It is a white crystalline powder that is soluble in hot water, chloroform, and other polar solvents. Maltol is registered as a flavor component in the EU. Maltol, like related 3-hydroxy-4-pyrones such as kojic acid, binds to hard metal centers such as Fe3+, Ga3+, Al3+, and VO2+. It is known in the European E number food additive series as E636. Because it has the odor of cotton candy and caramel, maltol is used to impart a sweet aroma to fragrances. Maltol is a white crystalline powder with a fragrant caramel-butterscotch odor. pH (5\\\\% aqueous solution) 5.3. (NTP, 1992) 3-hydroxy-2-methyl-4-pyrone is a member of 4-pyranones. It has a role as a metabolite. Maltol is a natural product found in Cercidiphyllum japonicum, Coffea arabica, and other organisms with data available. 3-Hydroxy-2-methyl-4-pyrone is a metabolite found in or produced by Saccharomyces cerevisiae. Found in chicory, roasted malt, breads, milk, heated butter, uncured smoked pork, cocoa, coffee, roasted barley, roasted peanuts, roasted filbert, soybean etc. Flavour enhancer and flavouring agent C1907 - Drug, Natural Product > C28269 - Phytochemical Maltol, a type of aromatic compound, exists in high concentrations in red ginseng. Maltol is a potent antioxidative agent and typically is used to enhance flavor and preserve food[1]. Maltol, a type of aromatic compound, exists in high concentrations in red ginseng. Maltol is a potent antioxidative agent and typically is used to enhance flavor and preserve food[1].

   

1,3,5-Trihydroxybenzene

Phloroglucinol (1,3,5-benzenetriol)

C6H6O3 (126.0317)


Phloroglucinol, also known as 1,3,5-benzenetriol or 1,3,5-trihydroxybenzene, belongs to phloroglucinols and derivatives class of compounds. Those are compounds containing a phloroglucinol (benzene-1,3,5-triol) moiety, which consists of a benzene ring bearing one hydroxyl group at positions 1,3, and 5. Phloroglucinol is soluble (in water) and a very weakly acidic compound (based on its pKa). Phloroglucinol can be found in a number of food items such as garden onion, tea, soft-necked garlic, and tarragon, which makes phloroglucinol a potential biomarker for the consumption of these food products. Phloroglucinol can be found primarily in feces. Phloroglucinol is an organic compound that is used in the synthesis of pharmaceuticals and explosives. It is a phenol derivative with antispasmodic properties that is used primarily as a laboratory reagent . Phloroglucinol is a benzenetriol. It is an organic compound that is used in the synthesis of pharmaceuticals and explosives. This molecule exists in two forms, or tautomers, 1,3,5-trihydroxybenzene, which has phenol-like, and 1,3,5-cyclohexanetrione (phloroglucin), which has ketone-like character. These two tautomers are in equilibrium. Phloroglucinol is a useful intermediate because it is polyfunctional. 1,3,5-Trihydroxybenzene has been found to be a metabolite in Pseudomonas (PMID: 15826166). A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

Hydroxyhydroquinone

1,2,4-Trihydroxybenzene

C6H6O3 (126.0317)


1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1]. 1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1].

   

Formyl phosphate

Formyl phosphate

CH3O5P (125.9718)


   

2-Hydroxyethylphosphonate

(2-Hydroxyethyl)phosphonic acid

C2H7O4P (126.0082)


   

Foscarnet

Dihydroxyphosphinecarboxylic acid oxide

CH3O5P (125.9718)


Foscarnet is only found in individuals that have used or taken this drug. It is an antiviral agent used in the treatment of cytomegalovirus retinitis. Foscarnet also shows activity against human herpesviruses and HIV. [PubChem]Foscarnet exerts its antiviral activity by a selective inhibition at the pyrophosphate binding site on virus-specific DNA polymerases at concentrations that do not affect cellular DNA polymerases. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AD - Phosphonic acid derivatives C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97453 - Non-nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

5-Hydroxymethyl-2-furancarboxaldehyde

5-(hydroxymethyl)furan-2-carbaldehyde;5-(Hydroxymethyl)furfural

C6H6O3 (126.0317)


5-hydroxymethylfurfural is a member of the class of furans that is furan which is substituted at positions 2 and 5 by formyl and hydroxymethyl substituents, respectively. Virtually absent from fresh foods, it is naturally generated in sugar-containing foods during storage, and especially by drying or cooking. It is the causative component in honey that affects the presystemic metabolism and pharmacokinetics of GZ in-vivo. It has a role as an indicator and a Maillard reaction product. It is a member of furans, an arenecarbaldehyde and a primary alcohol. Aes-103 has been used in trials studying the treatment and prevention of Hypoxia, Anemia, Sickle Cell, and Sickle Cell Disease. 5-Hydroxymethylfurfural is a natural product found in Prunus mume, Tussilago farfara, and other organisms with data available. 5-Hydroxymethyl-2-furancarboxaldehyde belongs to the family of Furans. These are compounds containing a furan ring, which is a five-member aromatic ring with one oxygen atom, four carbon atoms. 5-Hydroxymethyl-2-furancarboxaldehyde is found in garden onion. Obtainable from various carbohydrates. 5-Hydroxymethyl-2-furancarboxaldehyde is present in tomatoes, tobacco oil etc. 5-Hydroxymethyl-2-furancarboxaldehyde is a constituent of numerous plant species. 5-Hydroxymethyl-2-furancarboxaldehyde is used as an index of heat treatment and deterioration in food such as tomato paste, honey and fruit juices. Also an indicator of adulteration with acid-converted invert sugars. 5-Hydroxymethylfurfural is a biomarker for the consumption of beer 5-Hydroxymethyl-2-furancarboxaldehyde or simply HMF is obtainable from various carbohydrates. It is found in garden tomatoes, garden onion, and tobacco oil. Constituent of numerous plant spp.. Used as an index of heat treatment and deterioration in food such as tomato paste, honey and fruit juices. Also an indicator of adulteration with acid-converted invert sugars. 5-Hydroxymethylfurfural is a biomarker for the consumption of beer. 5-Hydroxymethylfurfural (2-Hydroxymethyl-5-furfural), derived from Cornus officinalis, inhibits yeast growth and fermentation as stressors. 5-Hydroxymethylfurfural (2-Hydroxymethyl-5-furfural), derived from Cornus officinalis, inhibits yeast growth and fermentation as stressors.

   

4-Chlorotoluene

4-Chlorotoluene, 38CL-labeled

C7H7Cl (126.0236)


   

DIMETHYL SULFATE

DIMETHYL SULFATE

C2H6O4S (125.9987)


D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D009153 - Mutagens The dimethyl ester of sulfuric acid.

   

4-hydroxy-5-methyl-2-methylene-3(2H)-furanone

4-hydroxy-5-methyl-2-methylene-3(2H)-furanone

C6H6O3 (126.0317)


   

Benzyl chloride

Benzyl chloride, 14C-labeled

C7H7Cl (126.0236)


Benzyl chloride belongs to the family of Substituted Benzenes. These are aromatic compounds containing a benzene substituted at one or more positions.

   

5-Methyl-2-thiophenecarboxaldehyde

5-Methyl-2-thiophenecarboxaldehyde, analytical standard

C6H6OS (126.0139)


5-Methyl-2-thiophenecarboxaldehyde, also known as 2-formyl-5-methylthiophene or 5-methyl-2-carboxaldehyde-thiophene, belongs to the class of organic compounds known as 2,5-disubstituted thiophenes. These are organic compounds containing a thiophene that is disubstituted at the C-2, and C5-positions. 5-Methyl-2-thiophenecarboxaldehyde is a sweet, acetophenone, and almond tasting compound. 5-Methyl-2-thiophenecarboxaldehyde is a member of thiophenes. 5-Methyl-2-thiophenecarboxaldehyde is a natural product found in Nicotiana tabacum with data available. 5-methyl-2-thiophenecarboxaldehyde is a metabolite found in or produced by Saccharomyces cerevisiae. 5-Methyl-2-thiophenecarboxaldehyde acts as a candidate to microscopic third order non-linear optical (NLO) material[1].

   

Methyl 2-furoate

Furan-alpha-carboxylic acid methyl ester

C6H6O3 (126.0317)


Methyl 2-furoate, also known as fema 2703 or methyl pyromucate, belongs to the class of organic compounds known as furoic acid esters. These are ester derivatives of furoic acid. Methyl 2-furoate is a sweet, fruity, and fungal tasting compound. Methyl 2-furoate has been detected, but not quantified, in several different foods, such as fruits, coffee and coffee products, nuts, green vegetables, and cocoa and cocoa products. This could make methyl 2-furoate a potential biomarker for the consumption of these foods. It is used in food flavouring. Found in cranberries, guava fruits, raisins and other fruitsand is also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra (Hibiscus esculentus) and other foodstuffs. Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc. Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc.

   

Dimethylphosphate

Dimethyl phosphate, potassium salt

C2H7O4P (126.0082)


Dimethylphosphate, also known as dimethyl hydrogen phosphate, is classified as a member of the Dialkyl phosphates. Dialkyl phosphates are organic compounds containing a phosphate group that is linked to exactly two alkyl chain. Dimethylphosphate is considered to be soluble (in water) and acidic. (ChemoSummarizer)

   

4-Hydroxy-2H-pyran-3-carboxaldehyde

4-Hydroxy-2H-pyran-3-carboxaldehyde

C6H6O3 (126.0317)


4-Hydroxy-2H-pyran-3-carboxaldehyde is found in fruits. 4-Hydroxy-2H-pyran-3-carboxaldehyde is a constituent of Punica granatum (pomegranate)

   

Ethyl hydrogen sulfate

Sulfuric acid, monoethyl ester

C2H6O4S (125.9987)


Ethyl hydrogen sulfate is found in alcoholic beverages. Ethyl hydrogen sulfate is found in wine D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D009153 - Mutagens

   

Methyl methanethiosulfonate

Methanesulfonic acid, thio-, S-methyl ester

C2H6O2S2 (125.9809)


Methyl methanethiosulfonate is found in brassicas. Methyl methanethiosulfonate is isolated from cauliflower (Brassica oleracea var. botrytis). Methyl methanethiosulfonate is detected in the aroma of caucas (Allium victorialis). Antimutagenic agent Isolated from cauliflower (Brassica oleracea variety botrytis). Detected in the aroma of caucas (Allium victorialis). Antimutagenic agent. Methyl methanethiosulfonate is found in onion-family vegetables and brassicas.

   

2-Acetylthiophene

2,5-DIMETHYL-BENZENESULFONIC ACID

C6H6OS (126.0139)


2-Acetylthiophene, also known as 2-acetothienone or thiophene,2-acetyl, belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R, where R = aryl group and R=alkyl group. 2-Acetylthiophene is a sulfury tasting compound. 2-Acetylthiophene is found, on average, in the highest concentration within kohlrabis. 2-Acetylthiophene has also been detected, but not quantified, in asparagus. This could make 2-acetylthiophene a potential biomarker for the consumption of these foods. Organoleptic which contributes to several aromas. 2-Acetylthiophene is found in kohlrabi.

   

Ethylphosphate

Monoethyl phosphate, dipotassium salt

C2H7O4P (126.0082)


Ethylphosphate is produced by the reaction between diethylphosphate and water, with ethanol as a byproduct. [HMDB] Ethylphosphate is produced by the reaction between diethylphosphate and water, with ethanol as a byproduct.

   

(Z)-Tamarindienal

(3E)-2,5-dioxohex-3-enal

C6H6O3 (126.0317)


(Z)-Tamarindienal is found in fruits. (Z)-Tamarindienal is a constituent of Tamarindus indica (tamarind)

   

3-Acetylthiophene

1-(thiophen-3-yl)ethan-1-one

C6H6OS (126.0139)


3-Acetylthiophene is a maillard product; organoleptic. Maillard product; organoleptic

   

2-(Methylthio)pyrazine

2-(Methylsulphanyl)pyrazine

C5H6N2S (126.0252)


2-(Methylthio)pyrazine is a flavouring ingredient. Flavouring ingredient

   

Pyrazinemethanethiol

2-(Mercaptomethyl)pyrazine

C5H6N2S (126.0252)


Liq. with roasted, meat-like flavour Liq. with roasted, meat-like flavou

   

5-Methylfuran-2-carboxylic acid

5-Methylfuran-2-carboxylic acid

C6H6O3 (126.0317)


5-Methylfuran-2-carboxylic acid belongs to the family of Furoic Acid Derivatives. These are organic compounds containing a furoic acid moiety, whose structure is characterized by a furan ring bearing a carboxylic acid group at the C2 or C3 carbon atom.

   

1,1-Dichloroacetone

2-Propanone,1,1-dichloro-

C3H4Cl2O (125.9639)


   

1,3-Dichloroacetone

alpha,Alpha-dichloroacetone

C3H4Cl2O (125.9639)


   

2,3-Dimethylmaleic anhydride

dimethyl-2,5-dihydrofuran-2,5-dione

C6H6O3 (126.0317)


   

3-(Hydroxymethyl)furan-2-carbaldehyde

3-(Hydroxymethyl)furan-2-carbaldehyde

C6H6O3 (126.0317)


   

Hydroxy(oxo)methanesulfonic acid

Hydroxy(oxo)methanesulphonic acid

CH2O5S (125.9623)


   

Ethyl methylphosphonofluoridate

Ethyl methylphosphonofluoridic acid

C3H8FO2P (126.0246)


   

Fluroxene

(2,2,2-trifluoroethoxy)ethene

C4H5F3O (126.0292)


C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

Isomaltol

1-(3-hydroxyfuran-2-yl)ethan-1-one

C6H6O3 (126.0317)


Isomaltol is a member of the class of compounds known as aryl alkyl ketones. Aryl alkyl ketones are ketones have the generic structure RC(=O)R, where R = aryl group and R=alkyl group. Isomaltol is soluble (in water) and a very weakly acidic compound (based on its pKa). Isomaltol can be found in tamarind, which makes isomaltol a potential biomarker for the consumption of this food product. Isomaltol is a natural furan obtained by the enzymatic degradation of starch. It is also a flavor component in bread crust, produced by thermal degradation (caramelization) of sugars. Isomaltol is obtained after the Maillard reaction from an amino acid and a reducing sugar .

   

2-Hydroxyethylphosphonic acid

2-HYDROXYETHYL PHOSPHONIC ACID

C2H7O4P (126.0082)


   

1,2,4-Trihydroxybenzene

1,2,4-Trihydroxybenzene

C6H6O3 (126.0317)


1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1]. 1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1].

   

C(C=C(C=O)CC=O)=O

C(C=C(C=O)CC=O)=O

C6H6O3 (126.0317)


   

methyl furan-3-carboxylate

methyl furan-3-carboxylate

C6H6O3 (126.0317)


   

1-hydroxyethanesulfonic acid

1-hydroxyethanesulfonic acid

C2H6O4S (125.9987)


   

5-methoxyfuran-2-carbaldehyde

5-methoxyfuran-2-carbaldehyde

C6H6O3 (126.0317)


   

ISOMALTOL

ISOMALTOL

C6H6O3 (126.0317)


   

3-METHOXYPYRAN-4-ONE

3-METHOXYPYRAN-4-ONE

C6H6O3 (126.0317)


   

3-Carboxy-2,4-pentadienal lactol|4-oxo-2-vinyl-crotonic acid|4-Oxo-2-vinyl-crotonsaeure

3-Carboxy-2,4-pentadienal lactol|4-oxo-2-vinyl-crotonic acid|4-Oxo-2-vinyl-crotonsaeure

C6H6O3 (126.0317)


   

2-hydroxy-3-methyl-4H-pyran-4-one

2-hydroxy-3-methyl-4H-pyran-4-one

C6H6O3 (126.0317)


   

6-hydroxy-2H-pyran-3-carbaldehyde

6-hydroxy-2H-pyran-3-carbaldehyde

C6H6O3 (126.0317)


   

6,8-Dioxabicyclo[3.2.1]oct-2-en-4-one

6,8-Dioxabicyclo[3.2.1]oct-2-en-4-one

C6H6O3 (126.0317)


   

4-methylfuran-2-carboxylic acid

4-methylfuran-2-carboxylic acid

C6H6O3 (126.0317)


   

5-methylfuran-3-carboxylic Acid

5-methylfuran-3-carboxylic Acid

C6H6O3 (126.0317)


   

5-Hydroxy-3-vinyl-2(5H)-furanone

5-Hydroxy-3-vinyl-2(5H)-furanone

C6H6O3 (126.0317)


   

1,3-Dichloroacetone

1,3-Dichloroacetone

C3H4Cl2O (125.9639)


   

5-((Z)-2-Hydroxyethylidene)-2(5H)-furanone|5-[2-hydroxyethylidene]-2(5H)-furanone

5-((Z)-2-Hydroxyethylidene)-2(5H)-furanone|5-[2-hydroxyethylidene]-2(5H)-furanone

C6H6O3 (126.0317)


   

Furyl hydroxymethyl ketone

Furyl hydroxymethyl ketone

C6H6O3 (126.0317)


   

2-methylpyran-3,4-dione

2-methylpyran-3,4-dione

C6H6O3 (126.0317)


   

158360-01-1

158360-01-1

C6H6O3 (126.0317)


   

dimethylmaleic anhydride

2,3-DIMETHYLMALEIC ANHYDRIDE

C6H6O3 (126.0317)


   

5-Hydroxy-2-methyl-4H-pyran-4-one

5-Hydroxy-2-methyl-4H-pyran-4-one

C6H6O3 (126.0317)


   

2-oxohexa-4,5-cyclopropyl-5-enoate

2-oxohexa-4,5-cyclopropyl-5-enoate

C6H6O3 (126.0317)


   

4-Hydroxy-6-methyl-2-pyrone

4-Hydroxy-6-methyl-2-pyrone

C6H6O3 (126.0317)


   
   

phloroglucinol

phloroglucinol

C6H6O3 (126.0317)


A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents A benzenetriol with hydroxy groups at position 1, 3 and 5.

   

Benzene-1,2,4-triol

Benzene-1,2,4-triol

C6H6O3 (126.0317)


   

Pyrogallol

Pyrogallol

C6H6O3 (126.0317)


   

Larixinic acid

Larixinic acid

C6H6O3 (126.0317)


   

4-Hydroxy-6-Methylpyran-2-One

4-Hydroxy-6-Methylpyran-2-One

C6H6O3 (126.0317)


   

3-hydroxy-2-methyl-4-pyrone

3-hydroxy-2-methyl-4-pyrone

C6H6O3 (126.0317)


A natural product found in Cordyceps sinensis.

   

Ethyl sulfate

Sulfuric acid, monoethyl ester

C2H6O4S (125.9987)


D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D009153 - Mutagens

   

Isethionic acid

Isethionic acid

C2H6O4S (125.9987)


   

Maltol_major

Maltol_major

C6H6O3 (126.0317)


   

4-Hydroxy-6-Methylpyran-2-One_major

4-Hydroxy-6-Methylpyran-2-One_major

C6H6O3 (126.0317)


   

Allomaltol

Allomaltol

C6H6O3 (126.0317)


   

Dimethylmaleic acid anhydride

Dimethylmaleic acid anhydride

C6H6O3 (126.0317)


   

Dimethyl phosphate

Dimethyl hydrogen phosphate

C2H7O4P (126.0082)


   

METHYL FUROATE

Furan-α-carboxylic acid methyl ester

C6H6O3 (126.0317)


Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc. Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc.

   

3-Formyl-4-hydroxy-2H-pyran

4-Hydroxy-2H-pyran-3-carboxaldehyde

C6H6O3 (126.0317)


   

Dimethyl thiosulfonate

Methanesulfonic acid, thio-, S-methyl ester

C2H6O2S2 (125.9809)


   

5-Methyl-2-thenaldehyde

Thiophen-2-carboxaldehyde, 5-methyl

C6H6OS (126.0139)


5-Methyl-2-thiophenecarboxaldehyde acts as a candidate to microscopic third order non-linear optical (NLO) material[1].

   

2-Acetothienone

2,5-DIMETHYL-BENZENESULFONIC ACID

C6H6OS (126.0139)


   

3-Acetothienone

1-(thiophen-3-yl)ethan-1-one

C6H6OS (126.0139)


   

methylthio Pyrazine

2-(Methylsulfanyl)pyrazine

C5H6N2S (126.0252)


   

Pyrazinemethanethiol

2-(Mercaptomethyl)pyrazine

C5H6N2S (126.0252)


   

tetramethylphosphanium,chloride

tetramethylphosphanium,chloride

C4H12ClP (126.0365)


   

3-Chloropropanoyl chloride

3-Chloropropanoyl chloride

C3H4Cl2O (125.9639)


   

sodium phosphite

sodium phosphite

HNa2O3P (125.9459)


   

5-amino-2-pyridineethione

5-amino-2-pyridineethione

C5H6N2S (126.0252)


   

Z-1-Methoxy-3,3,3-trifluoropropene

Z-1-Methoxy-3,3,3-trifluoropropene

C4H5F3O (126.0292)


   

4,4,4-Trifluorobut-2-en-1-ol

4,4,4-Trifluorobut-2-en-1-ol

C4H5F3O (126.0292)


   

sodium,3-hydroxybutanoate

sodium,3-hydroxybutanoate

C4H7NaO3 (126.0293)


   

Pyrimidine, 5-(methylthio)- (8CI,9CI)

Pyrimidine, 5-(methylthio)- (8CI,9CI)

C5H6N2S (126.0252)


   

UNII:TF4710DNP9

UNII:TF4710DNP9

C4H7NaO3 (126.0293)


Sodium 2-hydroxybutanoate is an endogenous metabolite.

   

2-PHENYLTETRAHYDRO-2H-PYRAN-4-OL

2-PHENYLTETRAHYDRO-2H-PYRAN-4-OL

C3H3KO3 (125.9719)


   

Potassium tetrafluoroborate

Potassium tetrafluoroborate

BF4K (125.9666)


   

1,1-dichlorobutane

1,1-dichlorobutane

C4H8Cl2 (126.0003)


   

5-VINYLTHIAZOL-2-AMINE

5-VINYLTHIAZOL-2-AMINE

C5H6N2S (126.0252)


   

4-hydroxy-3-methylpyran-2-one

4-hydroxy-3-methylpyran-2-one

C6H6O3 (126.0317)


   

2-methylthiophene-3-carbaldehyde

2-methylthiophene-3-carbaldehyde

C6H6OS (126.0139)


   

3-AMINOPYRIDINE-4-THIOL

3-AMINOPYRIDINE-4-THIOL

C5H6N2S (126.0252)


   

Amitivir

Amitivir

C3H2N4S (126)


C471 - Enzyme Inhibitor > C2087 - Inosine Monophosphate Dehydrogenase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

2-(furan-3-yl)acetic acid

2-(furan-3-yl)acetic acid

C6H6O3 (126.0317)


   

2(1H)-Pyrimidinethione, 5-methyl- (9CI)

2(1H)-Pyrimidinethione, 5-methyl- (9CI)

C5H6N2S (126.0252)


   

Phosphorus pentafluoride

Phosphorus pentafluoride

F5P (125.9658)


   

2H-Pyran-2,6(3H)-dione,4-methyl-

2H-Pyran-2,6(3H)-dione,4-methyl-

C6H6O3 (126.0317)


   

3-Oxo-1-cyclopentene-1-carboxylic acid

3-Oxo-1-cyclopentene-1-carboxylic acid

C6H6O3 (126.0317)


   

3-aminopyridine-2(1H)-thione

3-aminopyridine-2(1H)-thione

C5H6N2S (126.0252)


   

chloromethylbenzene

chloromethylbenzene

C7H7Cl (126.0236)


   

2,3,3-trifluoroacrylic acid

2,3,3-trifluoroacrylic acid

C3HF3O2 (125.9929)


   

potassium,2-methylpropanoate

potassium,2-methylpropanoate

C4H7KO2 (126.0083)


   

2-Furylacetic acid

2-(Furan-2-yl)acetic acid

C6H6O3 (126.0317)


   

Acrylic anhydride

Acrylic anhydride

C6H6O3 (126.0317)


   

4,4,4-TRIFLUOROBUTAN-2-ONE

4,4,4-TRIFLUOROBUTAN-2-ONE

C4H5F3O (126.0292)


   

TRIFLUOROPYRUVIC ALDEHYDE

TRIFLUOROPYRUVIC ALDEHYDE

C3HF3O2 (125.9929)


   

4-Mercaptophenol

4-Mercaptophenol

C6H6OS (126.0139)


   

2-aminopyridine-3-thiol

2-aminopyridine-3-thiol

C5H6N2S (126.0252)


   

5-fluoropyrimidine-2-carbaldehyde

5-fluoropyrimidine-2-carbaldehyde

C5H3FN2O (126.0229)


   

4,4,4-Trifluorobutanal

4,4,4-Trifluorobutanal

C4H5F3O (126.0292)


   

dimethyl sulfate (13c2)

dimethyl sulfate (13c2)

C2H6O4S (125.9987)


   

oxalic acid,dihydrate

oxalic acid,dihydrate

C2H6O6 (126.0164)


   

3-Methyl-1,2,4-cyclopentanetrione

3-Methyl-1,2,4-cyclopentanetrione

C6H6O3 (126.0317)


   

2-Sulfanylphenol

2-Sulfanylphenol

C6H6OS (126.0139)


   

Sodium 3-hydroxybutyrate

3-Hydroxybutyric acid sodium

C4H7NaO3 (126.0293)


An organic sodium salt resulting from the replacement of the proton from the carboxy group of 3-hydroxybutyric acid by a sodium ion. 3-Hydroxybutyric acid sodium (β-Hydroxybutyric acid sodium) is a metabolite that is elevated in type I diabetes. 3-Hydroxybutyric acid sodium can modulate the properties of membrane lipids[1].

   

2-Thiopheneacetaldehyde

2-Thiopheneacetaldehyde

C6H6OS (126.0139)


   

Bicyclo[2.2.1]hepta-2,5-diene,7-chloro-

Bicyclo[2.2.1]hepta-2,5-diene,7-chloro-

C7H7Cl (126.0236)


   

Butane, 1,2-dichloro-

Butane, 1,2-dichloro-

C4H8Cl2 (126.0003)


   

2,2-DICHLOROBUTANE

2,2-DICHLOROBUTANE

C4H8Cl2 (126.0003)


   

Dichloroethylaluminum

Dichloroethylaluminum

C2H5AlCl2 (125.9584)


   

Potassium 2-oxiranecarboxylate

Potassium 2-oxiranecarboxylate

C3H3KO3 (125.9719)


   

2(1H)-Pyrimidinethione,4-methyl-

2(1H)-Pyrimidinethione,4-methyl-

C5H6N2S (126.0252)


   

(2R)-2-Chloropropanoyl chloride

(2R)-2-Chloropropanoyl chloride

C3H4Cl2O (125.9639)


   

3-Amino-6-mercaptopyridine

3-Amino-6-mercaptopyridine

C5H6N2S (126.0252)


   

(2-(2-CHLOROETHYL)PHENYL)METHANOL

(2-(2-CHLOROETHYL)PHENYL)METHANOL

C4H5F3O (126.0292)


   

2-(Methylthio)pyrimidine

2-(Methylthio)pyrimidine

C5H6N2S (126.0252)


   

1-bromopropane-1,1,2,2-d4

1-bromopropane-1,1,2,2-d4

C3H3BrD4 (125.9982)


   

2-thiophen-3-ylacetaldehyde

2-thiophen-3-ylacetaldehyde

C6H6OS (126.0139)


   

Thiazolo[5,4-d]isoxazole (9CI)

Thiazolo[5,4-d]isoxazole (9CI)

C4H2N2OS (125.9888)


   

potassium butyrate

potassium butyrate

C4H7KO2 (126.0083)


   

1,3-Dichlorobutane

1,3-Dichlorobutane

C4H8Cl2 (126.0003)


   

Methoxycarbonylsulfenyl chloride

Methoxycarbonylsulfenyl chloride

C2H3ClO2S (125.9542)


   

Sodium (3S)-3-hydroxybutanoate

Sodium (3S)-3-hydroxybutanoate

C4H7NaO3 (126.0293)


   

(R)-3-Hydroxybutanoic acid sodium

(R)-3-Hydroxybutanoic acid sodium

C4H7NaO3 (126.0293)


(R)-3-Hydroxybutanoic acid sodium ((R)-3-Hydroxybutyric acid) is a metabolite converted from acetoacetic acid catalyzed by 3-hydroxybutyrate dehydrogenase. (R)-3-Hydroxybutanoic acid sodium can function as a nutrition source, and as a precursor for vitamins, antibiotics and pheromones[1][2].

   

sodium,(3R)-3-hydroxybutanoate

sodium,(3R)-3-hydroxybutanoate

C4H7NaO3 (126.0293)


   

2-Thiophenecarboxamidine

2-Thiophenecarboxamidine

C5H6N2S (126.0252)


   

(THIOPHENE-2-SULFONYLAMINO)-ACETIC ACID

(THIOPHENE-2-SULFONYLAMINO)-ACETIC ACID

C3H3KO3 (125.9719)


   

2-(TRIFLUOROMETHYL)PROPIONALDEHYDE

2-(TRIFLUOROMETHYL)PROPIONALDEHYDE

C4H5F3O (126.0292)


   

2-Chloro-1,3,2-dioxaphospholane

2-Chloro-1,3,2-dioxaphospholane

C2H4ClO2P (125.9637)


   

Thiazolo[4,5-c]isoxazole (9CI)

Thiazolo[4,5-c]isoxazole (9CI)

C4H2N2OS (125.9888)


   

Thiazolo[5,4-d]oxazole (9CI)

Thiazolo[5,4-d]oxazole (9CI)

C4H2N2OS (125.9888)


   

Thiazolo[4,5-d]oxazole (9CI)

Thiazolo[4,5-d]oxazole (9CI)

C4H2N2OS (125.9888)


   

Propane,1,2-dichloro-2-methyl-

Propane,1,2-dichloro-2-methyl-

C4H8Cl2 (126.0003)


   

Ethenesulfonyl chloride

Ethenesulfonyl chloride

C2H3ClO2S (125.9542)


   

1,1,1-Trifluoro-2-butanone

1,1,1-Trifluoro-2-butanone

C4H5F3O (126.0292)


   

4-Chloro-1H-pyrrole-2-carbonitrile

4-Chloro-1H-pyrrole-2-carbonitrile

C5H3ClN2 (125.9985)


   

2-Fluoro-1,4-benzoquinone

2-Fluoro-1,4-benzoquinone

C6H3FO2 (126.0117)


   

4-(hydroxymethyl)furan-2-carbaldehyde

4-(hydroxymethyl)furan-2-carbaldehyde

C6H6O3 (126.0317)


   

Thiazolo[4,5-d]isoxazole (9CI)

Thiazolo[4,5-d]isoxazole (9CI)

C4H2N2OS (125.9888)


   

3-Methyl-2-furoic acid

3-Methyl-2-furoic acid

C6H6O3 (126.0317)


   

S-Methylisothioureahydrochloride

S-Methylisothioureahydrochloride

C2H7ClN2S (126.0018)


   

Potassium pyruvate

Potassium pyruvate

C3H3KO3 (125.9719)


   

1-Bromo-2-fluoroethane

1-Bromo-2-fluoroethane

C2H4BrF (125.948)


   

2-fluoroethyl chloroformate

2-fluoroethyl chloroformate

C3H4ClFO2 (125.9884)


   

1,4-Dichlorobutane

1,4-Dichlorobutane

C4H8Cl2 (126.0003)


   

Levoglucosenone

Levoglucosenone

C6H6O3 (126.0317)


   

Oxalic acid dihydrate

Oxalic acid dihydrate

C2H6O6 (126.0164)


Oxalic acid dihydrate is an endogenous metabolite. Oxalic acid dihydrate is an endogenous metabolite.

   

(Z)-3-Oxabicyclo[3.2.0]heptane-2,4-dione

(Z)-3-Oxabicyclo[3.2.0]heptane-2,4-dione

C6H6O3 (126.0317)


   

3-Methylthiophene-2-aldehyde

3-Methylthiophene-2-aldehyde

C6H6OS (126.0139)


   

2,2-dichloroethanimidamide

2,2-dichloroethanimidamide

C2H4Cl2N2 (125.9752)


   

2,3-dichloropropionaldehyde

2,3-dichloropropionaldehyde

C3H4Cl2O (125.9639)


   

4-AMINO-3-MERCAPTOPYRIDINE

4-AMINO-3-MERCAPTOPYRIDINE

C5H6N2S (126.0252)


   

2,3-Dichlorobutane

2,3-Dichlorobutane

C4H8Cl2 (126.0003)


   

Thiazolo[5,4-c]isoxazole (9CI)

Thiazolo[5,4-c]isoxazole (9CI)

C4H2N2OS (125.9888)


   

3-Chlorotoluene

3-Chlorotoluene

C7H7Cl (126.0236)


   

2-Chlorotoluene

2-Chlorotoluene

C7H7Cl (126.0236)


   

1-bromo-1-fluoroethane

1-bromo-1-fluoroethane

C2H4BrF (125.948)


   

2-methyl-3-furoic acid

2-methyl-3-furoic acid

C6H6O3 (126.0317)


   

4-Methyl-2-thiophenecarbaldehyde

4-Methyl-2-thiophenecarbaldehyde

C6H6OS (126.0139)


   

E-1-Methoxy-3,3,3-trifluoropropene

E-1-Methoxy-3,3,3-trifluoropropene

C4H5F3O (126.0292)


   

Perhydrocyclobuta[c]furan-1,3-dione

Perhydrocyclobuta[c]furan-1,3-dione

C6H6O3 (126.0317)


   

Sodium Oxybate

Sodium Oxybate

C4H7NaO3 (126.0293)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2199 - Adjuvant Analgesic N - Nervous system > N01 - Anesthetics > N01A - Anesthetics, general

   

Lithium squarate

Lithium squarate

C4Li2O4 (126.0117)


   

Isolevoglucosenone

Isolevoglucosenone

C6H6O3 (126.0317)


   

Benzenesulfenic acid

Benzenesulfenic acid

C6H6OS (126.0139)


   

Furfuryl formate

Furfuryl formate

C6H6O3 (126.0317)


   

Mercaptomethyl phosphonate

Mercaptomethyl phosphonate

CH3O3PS-2 (125.9541)


   

Fluroxene

Fluroxene

C4H5F3O (126.0292)


C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

Piral

2,2,2\"-[1,2,3-BENZENE-TRIYLTRIS(OXY)]TRIS[N,N,N-TRIETHYLETHANAMINIUM]

C6H6O3 (126.0317)


D020011 - Protective Agents > D000975 - Antioxidants Pyrogallol is a polyphenol compound, which has anti-fungal and anti-psoriatic properties. Pyrogallol is a reductant that is able to generate free radicals, in particular superoxide anions. Pyrogallol is a polyphenol compound, which has anti-fungal and anti-psoriatic properties. Pyrogallol is a reductant that is able to generate free radicals, in particular superoxide anions.

   

CPD-16

4-06-00-07361 (Beilstein Handbook Reference)

C6H6O3 (126.0317)


A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

67-47-0

InChI=1\C6H6O3\c7-3-5-1-2-6(4-8)9-5\h1-3,8H,4H

C6H6O3 (126.0317)


5-Hydroxymethylfurfural (2-Hydroxymethyl-5-furfural), derived from Cornus officinalis, inhibits yeast growth and fermentation as stressors. 5-Hydroxymethylfurfural (2-Hydroxymethyl-5-furfural), derived from Cornus officinalis, inhibits yeast growth and fermentation as stressors.

   

AI3-23585

5-18-06-00103 (Beilstein Handbook Reference)

C6H6O3 (126.0317)


Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc. Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc.

   

c0264

InChI=1\C6H6O3\c7-4-1-2-5(8)6(9)3-4\h1-3,7-9

C6H6O3 (126.0317)


1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1]. 1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1].

   

Vetol

5-18-01-00114 (Beilstein Handbook Reference)

C6H6O3 (126.0317)


C1907 - Drug, Natural Product > C28269 - Phytochemical Maltol, a type of aromatic compound, exists in high concentrations in red ginseng. Maltol is a potent antioxidative agent and typically is used to enhance flavor and preserve food[1]. Maltol, a type of aromatic compound, exists in high concentrations in red ginseng. Maltol is a potent antioxidative agent and typically is used to enhance flavor and preserve food[1].

   

WLN: G1R

Benzyl chloride, unstabilized [UN1738] [Poison, Corrosive]

C7H7Cl (126.0236)


   

766-39-2

InChI=1\C6H6O3\c1-3-4(2)6(8)9-5(3)7\h1-2H

C6H6O3 (126.0317)


   

AI3-26172

InChI=1\C2H6S3\c1-3-5-4-2\h1-2H

C2H6S3 (125.9632)


Dimethyl trisulfide is an organic chemical compound and the simplest organic trisulfide found in garlic, onion, broccoli, and similar plants. Dimethyl trisulfide is a cyanide antidote[1]. Dimethyl trisulfide is an organic chemical compound and the simplest organic trisulfide found in garlic, onion, broccoli, and similar plants. Dimethyl trisulfide is a cyanide antidote[1].

   

77-78-1

4-01-00-01251 (Beilstein Handbook Reference)

C2H6O4S (125.9987)


D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D009153 - Mutagens

   

2-(2-Methylidenecyclopropyl)-2-oxoacetic acid

2-(2-Methylidenecyclopropyl)-2-oxoacetic acid

C6H6O3 (126.0317)


   

Barbiturate(2-)

Barbiturate(2-)

C4H2N2O3-2 (126.0065)


   

5-Hydroxypyrrole-2-carboxylate

5-Hydroxypyrrole-2-carboxylate

C5H4NO3- (126.0191)


   

6,3-Dihydroxy-2-pyridinone

6,3-Dihydroxy-2-pyridinone

C5H4NO3- (126.0191)


   

[(1R)-1-hydroxyethyl]phosphonic acid

[(1R)-1-hydroxyethyl]phosphonic acid

C2H7O4P (126.0082)


   

4-Hydroxy-2H-pyran-3-carboxaldehyde

4-Hydroxy-2H-pyran-3-carboxaldehyde

C6H6O3 (126.0317)


   

(3E)-5-hydroxy-2-oxohexa-3,5-dienal

(3E)-5-hydroxy-2-oxohexa-3,5-dienal

C6H6O3 (126.0317)


   

Stiborane

Stiborane

H5Sb (125.9429)


   

2-Methyl-5-methylenefuran-3,4-dione

2-Methyl-5-methylenefuran-3,4-dione

C6H6O3 (126.0317)


   

2-Hydroxyethyl hydrogen sulfite

2-Hydroxyethyl hydrogen sulfite

C2H6O4S (125.9987)


   

foscarnet

foscarnet

CH3O5P (125.9718)


J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AD - Phosphonic acid derivatives C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97453 - Non-nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

Benzyl chloride

Benzyl chloride

C7H7Cl (126.0236)


   

1,2,4-BENZENETRIOL

1,2,4-Trihydroxybenzene

C6H6O3 (126.0317)


A benzenetriol carrying hydroxy groups at positions 1, 2 and 4. 1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1]. 1,2,4-Trihydroxybenzene (Hydroxyhydroquinone), a by-product of coffee bean roasting, increases intracellular Ca2+ concentration in rat thymic lymphocytes[1].

   

2-HYDROXYETHYL PHOSPHONIC ACID

(2-Hydroxyethyl)phosphonic acid

C2H7O4P (126.0082)


   

ethyl dihydrogen phosphate

ethyl dihydrogen phosphate

C2H7O4P (126.0082)


A monoalkyl phosphate epitope having ethyl as the alkyl group.

   

4-Chlorotoluene

4-Chlorotoluene

C7H7Cl (126.0236)


   

Methyl Methanethiosulfonate

S-Methyl methanethiosulfonate

C2H6O2S2 (125.9809)


A sulfonic acid derivative obtained by condensaton of methanesulfonic acid with methanethiol.

   

Methyl 2-furoate

Methyl 2-​furoate

C6H6O3 (126.0317)


Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc. Methyl 2-furoate (Methyl furan-2-carboxylate) is a building block in chemical synthesis. A flavoring agent in food. Found in cranberries, guava fruits, raisins and other fruits. Also present in baked potato, roasted filberts, roasted peanut, tomatoes, coffee, cocoa, okra, etc.

   

2-ACETYLTHIOPHENE

2,5-DIMETHYL-BENZENESULFONIC ACID

C6H6OS (126.0139)


   

2-Methylthio pyrazine

2-(Methylthio)pyrazine

C5H6N2S (126.0252)


   

2-Pyrazinylmethanethiol

2-Mercaptomethylpyrazine

C5H6N2S (126.0252)


   

3-Acetylthiophene

3-Acetylthiophene

C6H6OS (126.0139)


   

5-Methyl-2-furoic acid

5-Methylfuran-2-carboxylic acid

C6H6O3 (126.0317)


A member of the class of furoic acids that is 2-furoic acid substituted at position 5 by a methyl group.

   

(Z)-Tamarindienal

(Z)-Tamarindienal

C6H6O3 (126.0317)


   

Hydroxyethylphosphonic acid

Hydroxyethylphosphonic acid

C2H7O4P (126.0082)


   

Hydroxyethanesulfonate

Hydroxyethanesulfonate

C2H6O4S (125.9987)


   

Hydroxymethylfurancarboxaldehyde

Hydroxymethylfurancarboxaldehyde

C6H6O3 (126.0317)


   

Methylthiopyrazine

Methylthiopyrazine

C5H6N2S (126.0252)


   

5-hydroxy-3-methylidene-2h-furan-2-carbaldehyde

5-hydroxy-3-methylidene-2h-furan-2-carbaldehyde

C6H6O3 (126.0317)


   

2-formyl-5-methoxyfuran

NA

C6H6O3 (126.0317)


{"Ingredient_id": "HBIN005630","Ingredient_name": "2-formyl-5-methoxyfuran","Alias": "NA","Ingredient_formula": "C6H6O3","Ingredient_Smile": "COC1=CC=C(O1)C=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39331","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

5-hydromethyl furaldehyde

NA

C6H6O3 (126.0317)


{"Ingredient_id": "HBIN011564","Ingredient_name": "5-hydromethyl furaldehyde","Alias": "NA","Ingredient_formula": "C6H6O3","Ingredient_Smile": "C1=C(OC(=C1)C=O)CO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "38825","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(5z)-5-(2-hydroxyethylidene)furan-2-one

(5z)-5-(2-hydroxyethylidene)furan-2-one

C6H6O3 (126.0317)


   

2-furyl hydroxymethyl ketone

2-furyl hydroxymethyl ketone

C6H6O3 (126.0317)


   

4-hydroxy-3-methylfuran-2-carbaldehyde

4-hydroxy-3-methylfuran-2-carbaldehyde

C6H6O3 (126.0317)


   

5-hydroxy-3-methylfuran-2-carbaldehyde

5-hydroxy-3-methylfuran-2-carbaldehyde

C6H6O3 (126.0317)


   

5-(2-hydroxyethylidene)furan-2-one

5-(2-hydroxyethylidene)furan-2-one

C6H6O3 (126.0317)