Exact Mass: 120.0483

Exact Mass Matches: 120.0483

Found 150 metabolites which its exact mass value is equals to given mass value 120.0483, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Acetophenone

Acetophenone, TraceCERT(R), certified reference material

C8H8O (120.0575)


Acetophenone appears as a colorless liquid with a sweet pungent taste and odor resembling the odor of oranges. Freezes under cool conditions. Slightly soluble in water and denser than water. Hence sinks in water. Vapor heavier than air. A mild irritant to skin and eyes. Vapors can be narcotic in high concentrations. Used as a flavoring, solvent, and polymerization catalyst. Acetophenone is a methyl ketone that is acetone in which one of the methyl groups has been replaced by a phenyl group. It has a role as a photosensitizing agent, an animal metabolite and a xenobiotic. Acetophenone is used for fragrance in soaps and perfumes, as a flavoring agent in foods, and as a solvent for plastics and resins. Acute (short-term) exposure to acetophenone vapor may produce skin irritation and transient corneal injury in humans. No information is available on the chronic (long-term), reproductive, developmental, or carcinogenic effects of acetophenone in humans. EPA has classified acetophenone as a Group D, not classifiable as to human carcinogenicity. Acetophenone is a natural product found in Nepeta nepetella, Hypericum hyssopifolium, and other organisms with data available. Acetophenone is a metabolite found in or produced by Saccharomyces cerevisiae. Acetophenone is the organic compound with the formula C6H5C(O)CH3. It is the simplest aromatic ketone. This colourless, viscous liquid is a precursor to useful resins and fragrances. Acetophenone is found in chicory. Acetophenone is a flavouring ingredient used in fruit flavours. Acetophenone is a raw material for the synthesis of some pharmaceuticals and is also listed as an approved excipient by the U.S. FDA. In a 1994 report released by five top cigarette companies in the U.S., acetophenone was listed as one of the 599 additives to cigarettes. A methyl ketone that is acetone in which one of the methyl groups has been replaced by a phenyl group. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents Flavouring ingredient used in fruit flavours; leavening agent D003879 - Dermatologic Agents Acetophenone is an organic compound with simple structure[1]. Acetophenone is an organic compound with simple structure[1].

   

3-Methylbenzaldehyde

3-methylbenzaldehyde;3-Methylbenzaldehyde, stab. with 0.1\\% hydroquinone

C8H8O (120.0575)


3-Methylbenzaldehyde, also known as 3-tolylaldehyde, belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). 3-Methylbenzaldehyde exists in all living organisms, ranging from bacteria to humans. 3-Methylbenzaldehyde is a sweet, benzaldehyde, and cherry tasting compound. 3-Methylbenzaldehyde has been detected, but not quantified, in several different foods, such as sweet cherries, alcoholic beverages, garden tomato, coffee and coffee products, and tea. This could make 3-methylbenzaldehyde a potential biomarker for the consumption of these foods. A tolualdehyde compound with the methyl substituent at the 3-position. M-tolualdehyde is a tolualdehyde compound with the methyl substituent at the 3-position. It has a role as a plant metabolite. 3-Methylbenzaldehyde is a natural product found in Aloe africana, Cichorium endivia, and other organisms with data available. Flavouring ingredient. Component of FEMA 3068; see further under 4-Methylbenzaldehyde BHW21-S. 3-Methylbenzaldehyde is found in many foods, some of which are coffee and coffee products, nuts, tea, and garden tomato. A tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive. m-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive.

   

4-Vinylphenol

4-ethenylphenol

C8H8O (120.0575)


4-hydroxystyrene is a member of the class of phenols that is styrene carrying a hydroxy substituent at position 4. It has a role as a human urinary metabolite and a human xenobiotic metabolite. It derives from a hydride of a styrene. 4-Vinylphenol is a natural product found in Streptomyces, Cedronella canariensis, and other organisms with data available. 4-Vinylphenol is a metabolite found in or produced by Saccharomyces cerevisiae. 4-hydroxystyrene occurs frequently in different ciders, wines, foods and berries, e.g. cloudberry. Styrene is a prohapten metabolized in the skin by aryl hydrocarbon hydroxylase (AHH, EC 1.14.14.1) to styrene epoxide acting as the true hapten. Styrene occurs in nature and as a synthetic product.(PMID: 6713846). Flavour component of tea; flavouring ingredient

   

Purine

{7h-imidazo[4,} 5-D]pyrimidine

C5H4N4 (120.0436)


Purine, also known as purine base or 1H-purine, belongs to the class of organic compounds known as purines and purine derivatives. These are aromatic heterocyclic compounds containing a purine moiety, which is formed a pyrimidine-ring ring fused to an imidazole ring. Two of the bases in nucleic acids, adenine and guanine, are purines. Purines from food (or from tissue turnover) are metabolised by several enzymes, including xanthine oxidase, into uric acid. Purine exists in all living species, ranging from bacteria to humans. High levels of uric acid can predispose to gout when the acid crystalises in joints; this phenomenon only happens in humans and some animal species (e.g. dogs) that lack an intrinsic uricase enzyme that can further degrade uric acid. In humans, purine is involved in thioguanine action pathway. Outside of the human body, purine is found, on average, in the highest concentration within cocoa beans. Purine has also been detected, but not quantified in several different foods, such as rapinis, plains prickly pears, blackcurrants, radish, and parsley. This could make purine a potential biomarker for the consumption of these foods. Purine is a heterocyclic aromatic organic compound, consisting of a pyrimidine ring fused to an imidazole ring. A purine is a heterocyclic aromatic organic compound, consisting of a pyrimidine ring fused to an imidazole ring. Purines, including substituted purines and their tautomers, are the most widely distributed kind of nitrogen-containing heterocycle in nature. Purine is found in many foods, some of which are triticale, chickpea, japanese persimmon, and wild carrot. KEIO_ID P049 Purine is an endogenous metabolite. Purine is an endogenous metabolite.

   

Phenylacetaldehyde

alpha-Phenylacetaldehyde

C8H8O (120.0575)


Phenylacetaldehyde is one important oxidation-related aldehyde. Exposure to styrene gives phenylacetaldehyde as a secondary metabolite. Styrene has been implicated as reproductive toxicant, neurotoxicant, or carcinogen in vivo or in vitro. Phenylacetaldehyde could be formed by diverse thermal reactions during the cooking process together with C8 compounds is identified as a major aroma- active compound in cooked pine mushroom. Phenylacetaldehyde is readily oxidized to phenylacetic acid. Therefore will eventually be hydrolyzed and oxidized to yield phenylacetic acid that will be excreted primarily in the urine in conjugated form. (PMID: 16910727, 7818768, 15606130). Found in some essential oils, e.g. Citrus subspecies, Tagetes minuta (Mexican marigold) and in the mushroom Phallus impudicus (common stinkhorn). Flavouring ingredient COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Erythrose

(R*,r*)-2,3,4-trihydroxybutanal

C4H8O4 (120.0423)


Erythrose is a tetrose saccharide with the chemical formula C4H8O4. It has one aldehyde group, and is thus part of the aldose family. The natural isomer is D-erythrose. It is a member of the class of compounds known as pentoses. Pentoses are monosaccharides in which the carbohydrate moiety contains five carbon atoms. Erythrose is very soluble (in water). Erythrose can be found in blood, as well as in human cartilage tissue. Within the cell, erythrose is primarily located in the cytoplasm (predicted from logP). Erythrose exists in all living organisms, ranging from bacteria to humans. Erythrose is found to be associated with schizophrenia. Erythrose was first isolated in 1849 from rhubarb by the French pharmacist Louis Feux Joseph Garot (1798-1869) and was named as such because of its red hue in the presence of alkali metals. D-erythrose is a tetrose carbohydrate with chemical formula C4H8O4. It has one aldehyde group and so is part of the aldose family. It is a syrupy liquid at room temperature. [HMDB] Acquisition and generation of the data is financially supported in part by CREST/JST.

   

L-Erythrulose

(3S)-1,3,4-Trihydroxybutan-2-one

C4H8O4 (120.0423)


L-Erythrulose is an extremely reactive ketose, which rapidly glycates and crosslinks proteins, and therefore may mediate the(L-ascorbate) AsA-dependent modification of protein (ascorbylation) seen in vitro, and also proposed to occur in vivo in human lens during diabetic and age-onset cataract formation.(PMID: 10727845) [HMDB] L-Erythrulose is an extremely reactive ketose, which rapidly glycates and crosslinks proteins, and therefore may mediate the(L-ascorbate) AsA-dependent modification of protein (ascorbylation) seen in vitro, and also proposed to occur in vivo in human lens during diabetic and age-onset cataract formation.(PMID: 10727845).

   

Styrene Oxide

Styrene oxide, (+-)-isomer

C8H8O (120.0575)


Styrene Oxide, also known as Epoxystyrene or Phenyloxirane, is classified as a benzene or a Benzene derivative. Benzenes are aromatic compounds containing one monocyclic ring system consisting of benzene. Styrene Oxide is considered to be slightly soluble (in water) and basic D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens

   

4-Methylbenzaldehyde

Para-methylbenzaldehyde

C8H8O (120.0575)


4-Methylbenzaldehyde, also known as p-toluylaldehyde or p-formyltoluene, belongs to the class of organic compounds known as benzoyl derivatives. A tolualdehyde compound with the methyl substituent at the 4-position. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). 4-Methylbenzaldehyde is a cherry and fruity tasting compound. 4-Methylbenzaldehyde has been detected, but not quantified, in several different foods, such as caraway, sweet cherries, tea, nuts, and coffee and coffee products. Component of *FEMA 3068* together with the o- and m-isomers. Flavouring ingredient. Methylbenzaldehydes are present in roasted nuts, cooked beef, cider, tomato, coffee, tea and elderberry juice. 4-Methylbenzaldehyde is found in many foods, some of which are tea, caraway, nuts, and garden tomato. p-Tolualdehyde is an endogenous metabolite. p-Tolualdehyde is an endogenous metabolite.

   

2-Methylbenzaldehyde

2-Methyl-benzaldehyde

C8H8O (120.0575)


Component of FEMA 3068. Flavouring ingredient (see further under 4-Methylbenzaldehyde BHW21-S). 2-Methylbenzaldehyde is found in many foods, some of which are alcoholic beverages, soft-necked garlic, animal foods, and caraway. 2-Methylbenzaldehyde is found in alcoholic beverages. 2-Methylbenzaldehyde is a component of FEMA 3068. 2-Methylbenzaldehyde is a flavouring ingredient (see further under 4-Methylbenzaldehyde BHW21-S

   

(S)-Styrene oxide

(S)-Styrene oxide

C8H8O (120.0575)


The (S)-enantiomer of styrene oxide.

   

D-Threose

(3S,4R)-oxolane-2,3,4-triol

C4H8O4 (120.0423)


Acquisition and generation of the data is financially supported in part by CREST/JST.

   

2,3-Dihydrobenzofuran

InChI=1/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H

C8H8O (120.0575)


2,3-dihydrobenzofuran is a member of the class of 1-benzofurans that is the 2,3-dihydroderivative of benzofuran. It has a role as a metabolite. 2,3-Dihydrobenzofuran is a natural product found in Phyla nodiflora, Vitis vinifera, and other organisms with data available. 2,3-dihydrobenzofuran, also known as coumaran, is a clear very slight yellow oily liquid. It is slightly soluble in water, and is formed by reducing coumarone of which it is the dihydride. A member of the class of 1-benzofurans that is the 2,3-dihydroderivative of benzofuran. Coumaran (2,3-Dihydrobenzofuran) is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide[1]. Coumaran (2,3-Dihydrobenzofuran) is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide[1].

   

3,4-dihydroxybutyrate

3,4-Dihydroxybutanoic acid, monosodium salt

C4H8O4 (120.0423)


3,4-Dihydroxybutyric acid (also known as 3,4-Dihydroxybutanoic acid or 3,4-DB, or 2-deoxytetronic acid, or 2-DTA) is a normal human urinary metabolite that is excreted in increased concentration in patients with succinic semialdehyde dehydrogenase (SSADH) deficiency (PMID 12127325), which is a genetic disorder. SSADH deficiency is caused by an enzyme deficiency in GABA degradation. The most constant features with this disease are developmental delay, hypotonia and intellectual disability. Nearly half of SSADH patients exhibit ataxia, behavioral problems, seizures, and hyporeflexia. Normal adults excrete 0.37 +/- 0.15 (SD) mmoles of 3,4-dihydroxybutyrate per 24 hr. 3,4-dihydroxybutyrate is also detectable in blood. The renal clearance of 3,4-dihydroxybutyrate is roughly equal that of creatinine. 3,4-dihydroxybutyric acid has also been found in foods and is believed to be formed via the degradation (cooking) of di- and poly-saccharides (PMID: 1167165). 3,4-Dihydroxybutyric acid is believed to play a role in satiety or the feeling of fullness and suppresses food intake (PMID: 3191387; PMID: 6720928). 3,4-dihydroxybutyric acid is also elevated in the serum of individuals with dementia and may even serve as a predictive biomarker for dementia (PMID: 25177334). 3,4-Dihydroxybutyric acid is also a metabolite produced in Escherichia (PMID: 28342964). 3,4-Dihydroxybutyric acid is a normal human urinary metabolite that is excreted in increased concentration in patients with succinic semialdehyde dehydrogenase (SSADH) deficiency. (PMID 12127325) Normal adults excrete 0.37 +/- 0.15 (SD) mmoles of 3,4-dihydroxybutyrate per 24 hr. The compound is also detectable in blood. The renal clearance of this compound is roughly equal that of creatinine. [HMDB]

   

Lentialexin

oct-7-en-3,5-diyn-1-ol

C8H8O (120.0575)


Lentialexin is found in mushrooms. Lentialexin is produced by a mixed culture of Lentinus edodes (shiitake) and Trichoderma polysporum. Production by a mixed culture of Lentinus edodes (shiitake) and Trichoderma polysporum. Lentialexin is found in mushrooms.

   

2,4-Dihydroxybutanoic acid

2,4-Dihydroxy-butyric acid

C4H8O4 (120.0423)


2,4-Dihydroxybutanoic acid or 3-Deoxytetronic acid is usually absent in normal human urine extracts or in only trace constituents in neonates. (PMID 1192581) However, various cases of succinic semialdehyde dehydrogenase deficiency have shown consistently increased amounts of this metabolite. (PMID 3126356) [HMDB] 2,4-Dihydroxybutanoic acid or 3-Deoxytetronic acid is usually absent in normal human urine extracts or in only trace constituents in neonates. (PMID 1192581) However, various cases of succinic semialdehyde dehydrogenase deficiency have shown consistently increased amounts of this metabolite. (PMID 3126356).

   

4-Deoxyerythronic acid

(+/-)-erythro-2,3-dihydroxybutyric acid

C4H8O4 (120.0423)


4-Deoxyerythronic acid is a normal organic acid present in human biofluids (PMIDs 2338430, 3829393, 3525594, 14708889, 1560100, 6725493), derived presumably from L-threonine. (PMID 2947647) It has been associated with uremia (PMID 1149237) and diabetes mellitus type 1. (PMID 2947647) [HMDB] 4-Deoxyerythronic acid is a normal organic acid present in human biofluids (PMIDs 2338430, 3829393, 3525594, 14708889, 1560100, 6725493), derived presumably from L-threonine. (PMID 2947647) It has been associated with uremia (PMID 1149237) and diabetes mellitus type 1. (PMID 2947647).

   

4-Deoxythreonic acid

(2R,3S)-Rel-2,3-dihydroxy--butanoic acid

C4H8O4 (120.0423)


4-Deoxythreonic acid is a normally occurring carboxylic acid in human. (PMID: 3829393, 6725493). Metabolic profiling of urinary organic acids from patients with juvenile-onset (Type 1) diabetes mellitus have revealed significantly elevated levels of 4-deoxythreonic acid. (PMID: 2947647). The normal urinary constituent 4-deoxythreonic acid was found to diminish in urine incubated with E. coli. (PMID: 3910670). 4-Deoxythreonic acid is a normally occurring carboxylic acid in human. (PMID: 3829393, 6725493)

   

A,b-Dihydroxyisobutyric acid

2,3-dihydroxy-2-methyl-propanoic acid

C4H8O4 (120.0423)


2-methylglyceric acid or a,b-Dihydroxyisobutyric acid has been found not to be a normal metabolite but is a degradation product of thymine glycol in vivo. (PMID:3707888) [HMDB] 2-methylglyceric acid or a,b-Dihydroxyisobutyric acid has been found not to be a normal metabolite but is a degradation product of thymine glycol in vivo. (PMID:3707888).

   

(2-Hydroxyethoxy)acetic acid

2-(2-hydroxyethoxy)acetic acid

C4H8O4 (120.0423)


   

1,4-Diamino-2-chloro-2-butene

1,4-Diamino-2-chloro-2-butene

C4H9ClN2 (120.0454)


   

1H-Pyrazolo[4,3-d]pyrimidine

1H-Pyrazolo[4,3-d]pyrimidine

C5H4N4 (120.0436)


   

2,3-Dihydroxybutanoic acid

2,3-Dihydroxybutanoic acid

C4H8O4 (120.0423)


   

5-Aminopyrimidine-2-carbonitrile

5-Aminopyrimidine-2-carbonitrile

C5H4N4 (120.0436)


   

D-Erythrose

Erythrose, (S-(r*,s*))-isomer

C4H8O4 (120.0423)


   

1,3-Dihydroxypropan-2-yl formate

1,3-Dihydroxypropan-2-yl formate

C4H8O4 (120.0423)


   

pyrazolopyridazine

1H-pyrazolo[4,3-c]pyridazine

C5H4N4 (120.0436)


   

1,4-Dioxane-2,5-diol

Glycolaldehyde dimer,mixture of stereoisomers

C4H8O4 (120.0423)


1,4-Dioxane-2,5-diol is an endogenous metabolite.

   

methyl glycerate

methyl glycerate

C4H8O4 (120.0423)


   
   

2-Ethenylphenol

2-Ethenylphenol

C8H8O (120.0575)


   

Purine

InChI=1\C5H4N4\c1-4-5(8-2-6-1)9-3-7-4\h1-3H,(H,6,7,8,9

C5H4N4 (120.0436)


Purine is an endogenous metabolite. Purine is an endogenous metabolite.

   

D-Erythrose

D-(-)-Erythrose

C4H8O4 (120.0423)


The D-enantiomer of erythrose.

   

D(-)-Threose

D-(-)-threose

C4H8O4 (120.0423)


   

Erythrose

Erythrose

C4H8O4 (120.0423)


   

phenylacetaldehyde

phenylacetaldehyde

C8H8O (120.0575)


An aldehyde that consists of acetaldehyde bearing a methyl substituent; the parent member of the phenylacetaldehyde class of compounds. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

4-Vinylphenol

4-Vinylphenol

C8H8O (120.0575)


   

glycolaldehyde

glycolaldehyde

C4H8O4 (120.0423)


   

2,4-Dihydroxybutanoic acid

2,4-Dihydroxybutanoic acid

C4H8O4 (120.0423)


A omega-hydroxy fatty acid that is butyric acid substituted by hydroxy groups at positions 2 and 4 respectively.

   

4-vinyl phenol

4-vinyl phenol

C8H8O (120.0575)


   

A,b-Dihydroxyisobutyric acid

A,b-Dihydroxyisobutyric acid

C4H8O4 (120.0423)


   

2,4-Dihydroxybutyric acid

2,4-Dihydroxybutyric acid

C4H8O4 (120.0423)


   

3S,4-dihydroxy-butyric acid

3S,4-dihydroxy-butanoic acid

C4H8O4 (120.0423)


   

4-deoxy-erythronic acid

2,3-dihydroxy-butanoic acid

C4H8O4 (120.0423)


   

4-Deoxy-threonic acid

2R,3S-dihydroxy-butanoic acid

C4H8O4 (120.0423)


   

3,4-Dihydroxybutyric acid

3,4-Dihydroxybutyric acid

C4H8O4 (120.0423)


A omega-hydroxy fatty acid that is butyric acid substituted by hydroxy groups at positions 3 and 4 respectively.

   

Glycolaldehyde dimer

1,4-Dioxane-2,5-diol, 2,5-Dihydroxy-1,4-dioxane, Hydroxyacetaldehyde dimer

C4H8O4 (120.0423)


1,4-Dioxane-2,5-diol is an endogenous metabolite.

   

2,4-dihydroxy-butanoic acid

2,4-dihydroxy-butanoic acid

C4H8O4 (120.0423)


   

a,b-dihydroxy-isobutyric acid

2,3-dihydroxy-2-methyl-propanoic acid

C4H8O4 (120.0423)


   

Kumaran

Coumaran (2,3-dihydrobenzofuran)

C8H8O (120.0575)


Coumaran (2,3-Dihydrobenzofuran) is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide[1]. Coumaran (2,3-Dihydrobenzofuran) is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide[1].

   

Lentialexin

oct-7-en-3,5-diyn-1-ol

C8H8O (120.0575)


   

FA 4:0;O2

2,3-dihydroxy-2-methyl-propanoic acid

C4H8O4 (120.0423)


   

FOH 8:5

oct-7-en-3,5-diyn-1-ol

C8H8O (120.0575)


   

1H-1,2,3-TRIAZOLO[4,5-B]PYRIDINE

1H-1,2,3-TRIAZOLO[4,5-B]PYRIDINE

C5H4N4 (120.0436)


   

L-Threose

L-(+)-threose

C4H8O4 (120.0423)


   

1-(13C)-1-phenyl-1-ethanone

1-(13C)-1-phenyl-1-ethanone

C8H8O (120.0575)


   

3,3-DIFLUOROCYCLOPENTANONE

3,3-DIFLUOROCYCLOPENTANONE

C5H6F2O (120.0387)


   

1h-pyrazolo[3,4-d]pyrimidine

1h-pyrazolo[3,4-d]pyrimidine

C5H4N4 (120.0436)


   

5-Aminopyrazine-2-carbonitrile

5-Aminopyrazine-2-carbonitrile

C5H4N4 (120.0436)


   

1,2,4-Triazolo[4,3-b]pyridazine

1,2,4-Triazolo[4,3-b]pyridazine

C5H4N4 (120.0436)


   

3-Vinylphenol

3-Vinylphenol

C8H8O (120.0575)


   

2-Amino-6-cyanopyrazine

2-Amino-6-cyanopyrazine

C5H4N4 (120.0436)


   

2-Amino-1-Pyrroline Hydrochloride

2-Amino-1-Pyrroline Hydrochloride

C4H9ClN2 (120.0454)


   

2-Amino-5-pyrimidinecarbonitrile

2-Amino-5-pyrimidinecarbonitrile

C5H4N4 (120.0436)


   

Acetophenone-1,2-13C2

Acetophenone-1,2-13C2

C8H8O (120.0575)


   

6-aminopyridazine-3-carbonitrile

6-aminopyridazine-3-carbonitrile

C5H4N4 (120.0436)


   

L-Erythrose

L-(+)-ERYTHROSE

C4H8O4 (120.0423)


   

Trimethylsilylmethanethiol

Trimethylsilylmethylsulfide

C4H12SSi (120.0429)


   

(S)-2,2-DIMETHYL-3-(N-BOC)-4-ETHYNYL-OXAZOLIDINE

(S)-2,2-DIMETHYL-3-(N-BOC)-4-ETHYNYL-OXAZOLIDINE

C4H8O4 (120.0423)


   

Methyl hydroxy(methoxy)acetate

Methyl hydroxy(methoxy)acetate

C4H8O4 (120.0423)


   

1-phenylethanone-2-13C

1-phenylethanone-2-13C

C8H8O (120.0575)


   

2-Amino-2-methylpropanenitrile hydrochloride

2-Amino-2-methylpropanenitrile hydrochloride

C4H9ClN2 (120.0454)


   

Dimethylolurea

Dimethylolurea

C3H8N2O3 (120.0535)


   

1H-Imidazo[4,5-b]pyrazine

1H-Imidazo[4,5-b]pyrazine

C5H4N4 (120.0436)


   

1H-[1,2,3]TRIAZOLO[4,5-C]PYRIDINE

1H-[1,2,3]TRIAZOLO[4,5-C]PYRIDINE

C5H4N4 (120.0436)


   

4-chlorobutanimidamide

4-chlorobutanimidamide

C4H9ClN2 (120.0454)


   

5-METHYL-4,5-DIHYDRO-1H-PYRAZOLE HYDROCHLORIDE

5-METHYL-4,5-DIHYDRO-1H-PYRAZOLE HYDROCHLORIDE

C4H9ClN2 (120.0454)


   

Pyrrolo[2,1-d]-1,2,3,5-tetrazine (9CI)

Pyrrolo[2,1-d]-1,2,3,5-tetrazine (9CI)

C5H4N4 (120.0436)


   

Cyclopropyl Carbamidine Hydrochloride

Cyclopropyl Carbamidine Hydrochloride

C4H9ClN2 (120.0454)


   

2-Pyrimidinecarbonitrile, 4-amino- (9CI)

2-Pyrimidinecarbonitrile, 4-amino- (9CI)

C5H4N4 (120.0436)


   

2-Aminobutanenitrile monohydrochloride

2-Aminobutanenitrile monohydrochloride

C4H9ClN2 (120.0454)


   

3-Pyridazinecarbonitrile,4-amino-(8CI,9CI)

3-Pyridazinecarbonitrile,4-amino-(8CI,9CI)

C5H4N4 (120.0436)


   

4-Amino-5-pyrimidinecarbonitrile

4-Amino-5-pyrimidinecarbonitrile

C5H4N4 (120.0436)


   

Phthalane

Phthalane

C8H8O (120.0575)


   

1,2,4-Triazolo[4,3-a]pyrazine

1,2,4-Triazolo[4,3-a]pyrazine

C5H4N4 (120.0436)


   

(1,2,4)Triazolo(1,5-a)pyrazine

(1,2,4)Triazolo(1,5-a)pyrazine

C5H4N4 (120.0436)


   

Cyclopropane-1-carboximidamide HCl

Cyclopropane-1-carboximidamide HCl

C4H9ClN2 (120.0454)


   

ETHYLMETHYLSILOXANE, 2-PHENYLPROPYLMETHYLSILOXANE COPOLYMER

ETHYLMETHYLSILOXANE, 2-PHENYLPROPYLMETHYLSILOXANE COPOLYMER

C3H12OSi2 (120.0427)


   

3-azidopyridine

3-azidopyridine

C5H4N4 (120.0436)


   

3-Aminopyrazine-2-carbonitrile

3-Aminopyrazine-2-carbonitrile

C5H4N4 (120.0436)


   

Trimethyl(methylsulfanyl)silane

Trimethyl(methylsulfanyl)silane

C4H12SSi (120.0429)


   

1,4-Dioxane-2,3-diol

1,4-Dioxane-2,3-diol

C4H8O4 (120.0423)


   

Methyl (S)-glycerate

Methyl (S)-glycerate

C4H8O4 (120.0423)


   

(R)-Styrene oxide

(R)-Styrene oxide

C8H8O (120.0575)


The (R)-enantiomer of styrene oxide.

   

BICYCLO[4.2.0]OCTA-1,3,5,7-TETRAEN-7-OL

BICYCLO[4.2.0]OCTA-1,3,5,7-TETRAEN-7-OL

C8H8O (120.0575)


   

3H-Pyrazolo[3,4-d]pyrimidine (8CI,9CI)

3H-Pyrazolo[3,4-d]pyrimidine (8CI,9CI)

C5H4N4 (120.0436)


   

2-Amino-4-cyanopyrimidine

2-Amino-4-cyanopyrimidine

C5H4N4 (120.0436)


   

4,7-DIAZA-1H-INDAZOLE

4,7-DIAZA-1H-INDAZOLE

C5H4N4 (120.0436)


   

[1,2,4]Triazolo[1,5-a]pyrimidine

[1,2,4]Triazolo[1,5-a]pyrimidine

C5H4N4 (120.0436)


   

1,1-Bis(hydroxymethyl)ure

1,1-Bis(hydroxymethyl)ure

C3H8N2O3 (120.0535)


   

2-Amino-N,3-dihydroxypropanamide

2-Amino-N,3-dihydroxypropanamide

C3H8N2O3 (120.0535)


   

beta-d-Erythrofuranose

beta-d-Erythrofuranose

C4H8O4 (120.0423)


   

1-Phenylethenol

1-Phenylethenol

C8H8O (120.0575)


   

Phenyl vinyl ether

Phenyl vinyl ether

C8H8O (120.0575)


   

Hyacinthin

InChI=1\C8H8O\c9-7-6-8-4-2-1-3-5-8\h1-5,7H,6H

C8H8O (120.0575)


COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Hypnon

InChI=1\C8H8O\c1-7(9)8-5-3-2-4-6-8\h2-6H,1H

C8H8O (120.0575)


D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents D003879 - Dermatologic Agents Acetophenone is an organic compound with simple structure[1]. Acetophenone is an organic compound with simple structure[1].

   

c0201

InChI=1\C8H8O\c1-7-2-4-8(6-9)5-3-7\h2-6H,1H

C8H8O (120.0575)


p-Tolualdehyde is an endogenous metabolite. p-Tolualdehyde is an endogenous metabolite.

   

Coumaran

InChI=1\C8H8O\c1-2-4-8-7(3-1)5-6-9-8\h1-4H,5-6H

C8H8O (120.0575)


Coumaran (2,3-Dihydrobenzofuran) is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide[1]. Coumaran (2,3-Dihydrobenzofuran) is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide[1].

   

c0242

InChI=1\C8H8O\c1-7-3-2-4-8(5-7)6-9\h2-6H,1H

C8H8O (120.0575)


m-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive. m-Tolualdehyde (3-Methylbenzaldehyde) is a tolualdehyde compound with the methyl substituent at the 3-position. m-Tolualdehyde can be used as a food additive.

   

LS-2404

InChI=1\C8H8O\c1-7-4-2-3-5-8(7)6-9\h2-6H,1H

C8H8O (120.0575)


   

(S)-3,4-Dihydroxybutyric acid

(S)-3,4-Dihydroxybutyric acid

C4H8O4 (120.0423)


   

S-acetylcysteaminium

S-acetylcysteaminium

C4H10NOS+ (120.0483)


   

1,4-Diamino-2-chloro-2-butene

1,4-Diamino-2-chloro-2-butene

C4H9ClN2 (120.0454)


   

Methylphenylsilane

Methylphenylsilane

C7H8Si (120.0395)


D001697 - Biomedical and Dental Materials

   

Acetophenone-alpha,alpha,alpha-d3

Acetophenone-alpha,alpha,alpha-d3

C8H8O (120.0575)


   

(2S)-oxolane-2,3,4-triol

(2S)-oxolane-2,3,4-triol

C4H8O4 (120.0423)


   

p-Tolualdehyde

4-Methylbenzaldehyde

C8H8O (120.0575)


A tolualdehyde compound with the methyl substituent at the 4-position. p-Tolualdehyde is an endogenous metabolite. p-Tolualdehyde is an endogenous metabolite.

   

Styrene oxide

Styrene oxide

C8H8O (120.0575)


An epoxide that is oxirane in which one of the hydrogens has been replaced by a phenyl group. D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens

   

2-Methylbenzaldehyde

2-Methylbenzaldehyde

C8H8O (120.0575)


   

L-Erythrulose

L-(+)-Erythrulose

C4H8O4 (120.0423)


   

(3R,4R)-oxolane-2,3,4-triol

(3R,4R)-oxolane-2,3,4-triol

C4H8O4 (120.0423)


   

Erythrulose

1,3,4-Trihydroxy-2-butanone

C4H8O4 (120.0423)


Erythrulose. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=40031-31-0 (retrieved 2024-08-19) (CAS RN: 40031-31-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

(3S,4R)-oxolane-2,3,4-triol

(3S,4R)-oxolane-2,3,4-triol

C4H8O4 (120.0423)


   

3,4-Dihydroxybutanoic acid

3,4-Dihydroxybutanoic acid

C4H8O4 (120.0423)


   

2,3-Dihydroxy-2-methylpropanoic acid

2,3-Dihydroxy-2-methylpropanoic acid

C4H8O4 (120.0423)


   

4-Deoxythreonic acid

4-Deoxythreonic acid

C4H8O4 (120.0423)


The (2S,3R)-stereoisomer of 2,3-dihydroxybutanoic acid.

   

(2R,3R)-2,3-dihydroxybutanoic acid

(2R,3R)-2,3-dihydroxybutanoic acid

C4H8O4 (120.0423)


   

oct-7-en-3,5-diyn-1-ol

oct-7-en-3,5-diyn-1-ol

C8H8O (120.0575)


   

2,3-Dihydroxybutanoic acid

2,3-Dihydroxybutanoic acid

C4H8O4 (120.0423)


A hydroxybutyric acid substituted by hydroxy groups at positions 2 and 3 respectively.

   

1H-Pyrazolo[4,3-d]pyrimidine

1H-Pyrazolo[4,3-d]pyrimidine

C5H4N4 (120.0436)


   

oxolane-2,3,4-triol

oxolane-2,3,4-triol

C4H8O4 (120.0423)


   

4-hydroxystyrene

4-hydroxystyrene

C8H8O (120.0575)


A member of the class of phenols that is styrene carrying a hydroxy substituent at position 4.

   

1H-Purine

1H-Purine

C5H4N4 (120.0436)


The 1H-tautomer of purine.

   

3H-purine

3H-purine

C5H4N4 (120.0436)


The 3H-tautomer of purine.

   

9H-Purine

9H-Purine

C5H4N4 (120.0436)


The 9H-tautomer of purine.

   

O-Tolualdehyde

O-Tolualdehyde

C8H8O (120.0575)


A tolualdehyde compound with the methyl substituent at the 2-position.

   

7H-Purine

7H-Purine

C5H4N4 (120.0436)


The 7H-tautomer of purine.

   

Methylbenzaldehyde

Methylbenzaldehyde

C8H8O (120.0575)


   

Deoxy-erythronic acid

Deoxy-erythronic acid

C4H8O4 (120.0423)


   

Deoxy-threonic acid

Deoxy-threonic acid

C4H8O4 (120.0423)


   

2,3-Dihydroxyisobutyric acid

2,3-Dihydroxyisobutyric acid

C4H8O4 (120.0423)


   

Dihydroxybutyric acid

Dihydroxybutyric acid

C4H8O4 (120.0423)


   

Dihydroxyisobutyric acid

Dihydroxyisobutyric acid

C4H8O4 (120.0423)


   

Hydroxystyrene

Hydroxystyrene

C8H8O (120.0575)


   

methyl 2,3-dihydroxypropanoate

methyl 2,3-dihydroxypropanoate

C4H8O4 (120.0423)


   

methyl (2s)-2,3-dihydroxypropanoate

methyl (2s)-2,3-dihydroxypropanoate

C4H8O4 (120.0423)


   

(z)-(hydroxyimino)(1-hydroxypropan-2-yl)oxidoazanium

(z)-(hydroxyimino)(1-hydroxypropan-2-yl)oxidoazanium

C3H8N2O3 (120.0535)


   

(3S), 4-dihydroxybutyric acid

(3s),4-dihydroxybutyricacid

C4H8O4 (120.0423)


{"Ingredient_id": "HBIN009633","Ingredient_name": "(3S), 4-dihydroxybutyric acid","Alias": "(3s),4-dihydroxybutyricacid","Ingredient_formula": "C4H8O4","Ingredient_Smile": "C(C(CO)O)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42785;5782","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

methyl (2r)-2,3-dihydroxypropanoate

methyl (2r)-2,3-dihydroxypropanoate

C4H8O4 (120.0423)


   

2-[hydroxy(nitroso)amino]propan-1-ol

2-[hydroxy(nitroso)amino]propan-1-ol

C3H8N2O3 (120.0535)