Exact Mass: 89.9937

Exact Mass Matches: 89.9937

Found 135 metabolites which its exact mass value is equals to given mass value 89.9937, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

L-Lactic acid

1-Hydroxyethane 1-carboxylic acid

C3H6O3 (90.0317)


Lactic acid is an organic acid. It is a chiral molecule, consisting of two optical isomers, L-lactic acid and D-lactic acid, with the L-isomer being the most common in living organisms. Lactic acid plays a role in several biochemical processes and is produced in the muscles during intense activity. In animals, L-lactate is constantly produced from pyruvate via the enzyme lactate dehydrogenase (LDH) in a process of fermentation during normal metabolism and exercise. It does not increase in concentration until the rate of lactate production exceeds the rate of lactate removal. This is governed by a number of factors, including monocarboxylate transporters, lactate concentration, the isoform of LDH, and oxidative capacity of tissues. The concentration of blood lactate is usually 1-2 mmol/L at rest, but can rise to over 20 mmol/L during intense exertion. There are some indications that lactate, and not glucose, is preferentially metabolized by neurons in the brain of several mammalian species, including mice, rats, and humans. Glial cells, using the lactate shuttle, are responsible for transforming glucose into lactate, and for providing lactate to the neurons. Lactate measurement in critically ill patients has been traditionally used to stratify patients with poor outcomes. However, plasma lactate levels are the result of a finely tuned interplay of factors that affect the balance between its production and its clearance. When the oxygen supply does not match its consumption, organisms adapt in many different ways, up to the point when energy failure occurs. Lactate, being part of the adaptive response, may then be used to assess the severity of the supply/demand imbalance. In such a scenario, the time to intervention becomes relevant: early and effective treatment may allow tissues and cells to revert to a normal state, as long as the oxygen machinery (i.e. mitochondria) is intact. Conversely, once the mitochondria are deranged, energy failure occurs even in the presence of normoxia. The lactate increase in critically ill patients may, therefore, be viewed as an early marker of a potentially reversible state (PMID: 16356243). When present in sufficiently high levels, lactic acid can act as an oncometabolite, an immunosuppressant, an acidogen, and a metabotoxin. An oncometabolite is a compound that promotes tumor growth and survival. An immunosuppressant reduces or arrests the activity of the immune system. An acidogen is an acidic compound that induces acidosis, which has multiple adverse effects on many organ systems. A metabotoxin is an endogenously produced metabolite that causes adverse health effects at chronically high levels. Chronically high levels of lactic acid are associated with at least a dozen inborn errors of metabolism, including 2-methyl-3-hydroxybutyryl CoA dehydrogenase deficiency, biotinidase deficiency, fructose-1,6-diphosphatase deficiency, glycogen storage disease type 1A (GSD1A) or Von Gierke disease, glycogenosis type IB, glycogenosis type IC, glycogenosis type VI, Hers disease, lactic acidemia, Leigh syndrome, methylmalonate semialdehyde dehydrogenase deficiency, pyruvate decarboxylase E1 component deficiency, pyruvate dehydrogenase complex deficiency, pyruvate dehydrogenase deficiency, and short chain acyl CoA dehydrogenase deficiency (SCAD deficiency). Locally high concentrations of lactic acid or lactate are found near many tumors due to the upregulation of lactate dehydrogenase (PMID: 15279558). Lactic acid produced by tumors through aerobic glycolysis acts as an immunosuppressant and tumor promoter (PMID: 23729358). Indeed, lactic acid has been found to be a key player or regulator in the development and malignant progression of a variety of cancers (PMID: 22084445). A number of studies have demonstrated that malignant transformation is associated with an increase in aerobic cellular lactate excretion. Lactate concentrations in various carcinomas (e.g. uterine cervix, head and neck, colorectal regi... Occurs in the juice of muscular tissue, bile etc. Flavour ingredient, food antioxidant. Various esters are also used in flavourings L-Lactic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=79-33-4 (retrieved 2024-07-01) (CAS RN: 79-33-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Lactate (Lactate acid) is the product of glycolysis. Lactate is produced by oxygen lack in contracting skeletal muscle in vivo, and can be removed under fully aerobic conditions. Lactate can be as a hemodynamic marker in the critically ill[1][2]. Lactate (Lactate acid) is the product of glycolysis. Lactate is produced by oxygen lack in contracting skeletal muscle in vivo, and can be removed under fully aerobic conditions. Lactate can be as a hemodynamic marker in the critically ill[1][2]. L-Lactic acid is a buildiing block which can be used as a precursor for the production of the bioplastic polymer poly-lactic acid. L-Lactic acid is a buildiing block which can be used as a precursor for the production of the bioplastic polymer poly-lactic acid.

   

Hydroxypropionic acid

beta-Hydroxypropionic acid

C3H6O3 (90.0317)


3-Hydroxypropionic acid is a carboxylic acid. It is an intermediate in the breakdown of branched-chain amino acids and propionic acid from the gut. Typically it originates from propionyl-CoA and a defect in the enzyme propionyl carboxylase. This leads to a buildup in propionyl-CoA in the mitochondria.  Such a buildup can lead to a disruption of the esterified CoA:free CoA ratio and ultimately to mitochondrial toxicity. Detoxification of these metabolic end products occurs via the transfer of the propionyl moiety to carnitine-forming propionyl-carnitine, which is then transferred across the inner mitochondrial membrane. 3-Hydroxypropionic acid is then released as the free acid. As an industrial chemical, it is used in the production of various chemicals such as acrylates in industry. When present in sufficiently high levels, 3-hydroxypropionic acid can act as an acidogen and a metabotoxin. An acidogen is an acidic compound that induces acidosis, which has multiple adverse effects on many organ systems. A metabotoxin is an endogenously produced metabolite that causes adverse health effects at chronically high levels. Chronically high levels of hydroxypropionic acid are associated with many inborn errors of metabolism including biotinidase deficiency, malonic aciduria, methylmalonate semialdehyde dehydrogenase deficiency, methylmalonic aciduria, methylmalonic aciduria due to cobalamin-related disorders, and propionic acidemia. Hydroxypropionic acid is an organic acid. Abnormally high levels of organic acids in the blood (organic acidemia), urine (organic aciduria), the brain, and other tissues lead to general metabolic acidosis. Acidosis typically occurs when arterial pH falls below 7.35. Infants with acidosis have symptoms that include poor feeding, vomiting, loss of appetite, weak muscle tone (hypotonia), and lack of energy (lethargy). These can progress to heart, liver, and kidney abnormalities, seizures, coma, and possibly death. These are also the characteristic symptoms of the IEMs mentioned above. Many affected children with organic acidemias experience intellectual disability or delayed development. In adults, acidosis or acidemia is characterized by headaches, confusion, feeling tired, tremors, sleepiness, and seizures. 3-Hydroxypropionic acid is also a microbial metabolite found in Escherichia, Klebsiella and Saccharomyces (PMID: 26360870).

   

Glyceraldehyde

(2R)-2,3-dihydroxypropanal

C3H6O3 (90.0317)


DL-Glyceraldehyde is a monosaccharide. DL-Glyceraldehyde is the simplest aldose. DL-Glyceraldehyde can be used for various biochemical studies[1].

   

Oxalate (ethanedioate)

Oxalate, monohydrogen monopotassium

C2H2O4 (89.9953)


Oxalic acid is a strong dicarboxylic acid occurring in many plants and vegetables. It is produced in the body by metabolism of glyoxylic acid or ascorbic acid. It is not metabolized but excreted in the urine. It is used as an analytical reagent and general reducing agent (Pubchem). Oxalic acid (IUPAC name: ethanedioic acid, formula H2C2O4) is a dicarboxylic acid with structure (HOOC)-(COOH). Because of the joining of two carboxyl groups, this is one of the strongest organic acids. It is also a reducing agent. The anions of oxalic acid as well as its salts and esters are known as oxalates (Wikipedia). Bodily oxalic acid may also be synthesized via the metabolism of either glyoxylic acid or unused ascorbic acid (vitamin C), which is a serious health consideration for long term megadosers of vitamin C supplements. 80\\\\% of kidney stones are formed from calcium oxalate. Some Aspergillus species produce oxalic acid, which reacts with blood or tissue calcium to precipitate calcium oxalate. There is some preliminary evidence that the administration of probiotics can affect oxalic acid excretion rates (and presumably oxalic acid levels as well) (Wikipedia). Oxalic acid is found to be associated with fumarase deficiency and primary hyperoxaluria I, which are inborn errors of metabolism. Oxalic acid is a marker for yeast overgrowth from Aspergillus, Penicillum and/or Candida. Can also be elevated due to exposures from vitamin C or ethylene glycol poisoning. Oxalate is elevated in the urine of children with autism. (PMID: 21911305). Oxalic acid has also been identified as a uremic toxin according to the European Uremic Toxin Working Group (PMID: 22626821). Oxalic acid, also known as oxalate or ethanedioic acid, belongs to dicarboxylic acids and derivatives class of compounds. Those are organic compounds containing exactly two carboxylic acid groups. Oxalic acid is soluble (in water) and a moderately acidic compound (based on its pKa). Oxalic acid can be found in a number of food items such as grape, sacred lotus, orange mint, and date, which makes oxalic acid a potential biomarker for the consumption of these food products. Oxalic acid can be found primarily in blood, saliva, sweat, and urine, as well as throughout most human tissues. Oxalic acid exists in all living organisms, ranging from bacteria to humans. Moreover, oxalic acid is found to be associated with fumarase deficiency, glycolic aciduria, hemodialysis, and primary hyperoxaluria I. Oxalic acid is a non-carcinogenic (not listed by IARC) potentially toxic compound. Oxalic acids acid strength is much greater than that of acetic acid. Oxalic acid is a reducing agent and its conjugate base, known as oxalate (C 2O2− 4), is a chelating agent for metal cations. Typically, oxalic acid occurs as the dihydrate with the formula C2H2O4·2H2O . Acute Exposure: If oxalic acid is swallowed, immediately give the person water or milk, unless instructed otherwise by a health care provider. DO NOT give water or milk if the person is having symptoms (such as vomiting, convulsions, or a decreased level of alertness) that make it hard to swallow. If acute exposure occurs to the eyes, irrigate opened eyes for several minutes under running water. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019163 - Reducing Agents Oxalic Acid is a strong dicarboxylic acid occurring in many plants and vegetables and can be used as an analytical reagent and general reducing agent. Oxalic Acid is a strong dicarboxylic acid occurring in many plants and vegetables and can be used as an analytical reagent and general reducing agent.

   

Dihydroxyacetone

Summers brand OF dihydroxyacetone

C3H6O3 (90.0317)


Dihydroxyacetone, also known as 1,3-dihydroxy-2-propanone or glycerone, is a member of the class of compounds known as monosaccharides. Monosaccharides are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn. Dihydroxyacetone is soluble (in water) and a very weakly acidic compound (based on its pKa). Dihydroxyacetone can be found in a number of food items such as cauliflower, green bell pepper, black cabbage, and sweet basil, which makes dihydroxyacetone a potential biomarker for the consumption of these food products. Dihydroxyacetone can be found primarily in urine, as well as in human muscle and stratum corneum tissues. Dihydroxyacetone exists in all living species, ranging from bacteria to humans. Dihydroxyacetone is primarily used as an ingredient in sunless tanning products. It is often derived from plant sources such as sugar beets and sugar cane, and by the fermentation of glycerin . Dihydroxyacetone (also known as DHA) is a ketotriose compound. Its addition to blood preservation solutions results in better maintenance of 2,3-diphosphoglycerate levels during storage. It is readily phosphorylated to dihydroxyacetone phosphate by triokinase in erythrocytes. In combination with naphthoquinones, it acts as a sunscreening agent. Dihydroxyacetone is the simplest of all ketoses and, having no chiral centre, is the only one that has no optical activity. Dihydroxyacetone is a simple non-toxic sugar. It is often derived from plant sources such as sugar beets and sugar cane, by the fermentation of glycerin. Dihydroxyacetone is a white crystalline powder which is water soluble. 1,3-Dihydroxyacetone (DHA), the main active ingredient in sunless tanning skin-care preparations and an important precursor for the synthesis of various fine chemicals, is produced on an industrial scale by microbial fermentation of glycerol over Gluconobacter oxydans[1]. 1,3-Dihydroxyacetone (DHA), the main active ingredient in sunless tanning skin-care preparations and an important precursor for the synthesis of various fine chemicals, is produced on an industrial scale by microbial fermentation of glycerol over Gluconobacter oxydans[1].

   

METHYLAZOXYMETHANOL

METHYLAZOXYMETHANOL

C2H6N2O2 (90.0429)


D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D013723 - Teratogens

   

(HYDROXYMETHYL)UREA

N-(Hydroxymethyl)urea

C2H6N2O2 (90.0429)


   

trans-3-Chloroallyl aldehyde

trans-3-Chloroallyl aldehyde

C3H3ClO (89.9872)


This compound belongs to the family of Enolates. These are salts of enols (or of the tautomeric aldehydes or ketones), in which the anionic charge is delocalized over oxygen and carbon, or similar covalent metal derivatives in which the metal is bound to oxygen.

   

Thial-1-Propene-1-thiol S-oxide

Thial-1-Propene-1-thiol S-oxide

C3H6OS (90.0139)


Lachrymatory factor of onion (Allium cepa). Thial-1-Propene-1-thiol S-oxide is found in garden onion and onion-family vegetables. Thial-1-Propene-1-thiol S-oxide is found in garden onion. Lachrymatory factor of onion (Allium cepa).

   

1-Chloro-2-methylpropene

1-Chloro-2-methyl-1-propene

C4H7Cl (90.0236)


   

3-Chloro-2-methylpropene

3-Chloro-2-methyl-1-propene

C4H7Cl (90.0236)


   

N-Nitroso-N-(hydroxymethyl)methylamine

N-Nitroso-N-methyl-N-hydroxymethylamine

C2H6N2O2 (90.0429)


   

Glyceraldehyde

alpha,beta-Dihydroxypropionaldehyde

C3H6O3 (90.0317)


Glyceraldehyde is a triose monosaccharide with chemical formula C3H6O3. It is the simplest of all common aldoses. It is a sweet, colourless crystalline solid that is an intermediate compound in carbohydrate metabolism. The word "glyceraldehyde" comes from combining glycerine and aldehyde, as glyceraldehyde is merely glycerine with one hydroxide changed to an aldehyde. Glyceraldehyde is produced from the action of the enzyme glyceraldehyde dehydrogenase, which converts glycerol to glyceraldehyde using NADP as a cofactor. When present at sufficiently high levels, glyceraldehyde can be a cytotoxin and a mutagen. A cytotoxin is a compound that kills cells. A mutagen is a compound that causes mutations in DNA. Glyceraldehyde is a highly reactive compound that can modify and cross-link proteins. Glyceraldehyde-modified proteins appear to be cytotoxic, depress intracellular glutathione levels, and induce reactive oxygen species (ROS) production (PMID:14981296). Glyceraldehyde has been shown to cause chromosome damage to human cells in culture and is mutagenic in the Ames bacterial test. Glyceraldehyde is a triose monosaccharide with chemical formula C3H6O3. It is the simplest of all common aldoses. It is a sweet colorless crystalline solid that is an intermediate compound in carbohydrate metabolism. The word comes from combining glycerine and aldehyde, as glyceraldehyde is merely glycerine with one hydroxide changed to an aldehyde. [HMDB] DL-Glyceraldehyde is a monosaccharide. DL-Glyceraldehyde is the simplest aldose. DL-Glyceraldehyde can be used for various biochemical studies[1].

   

Lactic acid

(R)-alpha-Hydroxypropionic acid

C3H6O3 (90.0317)


D-lactic acid, also known as D-lactate or D-2-hydroxypropanoic acid, belongs to alpha hydroxy acids and derivatives class of compounds. Those are organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon. D-lactic acid is soluble (in water) and a weakly acidic compound (based on its pKa). D-lactic acid can be found in a number of food items such as tamarind, onion-family vegetables, allspice, and acerola, which makes D-lactic acid a potential biomarker for the consumption of these food products. D-lactic acid can be found primarily in blood, cerebrospinal fluid (CSF), and urine, as well as throughout most human tissues. D-lactic acid exists in all living species, ranging from bacteria to humans. In humans, D-lactic acid is involved in a couple of metabolic pathways, which include pyruvaldehyde degradation and pyruvate metabolism. D-lactic acid is also involved in several metabolic disorders, some of which include pyruvate kinase deficiency, pyruvate decarboxylase E1 component deficiency (PDHE1 deficiency), pyruvate dehydrogenase complex deficiency, and leigh syndrome. Moreover, D-lactic acid is found to be associated with diabetes mellitus type 2 and schizophrenia. D-lactic acid is a non-carcinogenic (not listed by IARC) potentially toxic compound. In animals, L-lactate is constantly produced from pyruvate via the enzyme lactate dehydrogenase (LDH) in a process of fermentation during normal metabolism and exercise. It does not increase in concentration until the rate of lactate production exceeds the rate of lactate removal, which is governed by a number of factors, including monocarboxylate transporters, concentration and isoform of LDH, and oxidative capacity of tissues. The concentration of blood lactate is usually 1–2 mmol/L at rest, but can rise to over 20 mmol/L during intense exertion and as high as 25 mmol/L afterward . Lactic acid is an organic acid. It is a chiral molecule, consisting of two optical isomers, L-lactic acid and D-lactic acid, with the L-isomer being the most common in living organisms. Lactic acid plays a role in several biochemical processes and is produced in the muscles during intense activity. D-Lactic acid is the end product of the enzyme glyoxalase II (or hydroxyacyl-glutathione hydrolase) (EC 3.1.2.6), which converts the intermediate substrate S-lactoyl-glutathione to reduced glutathione and D-lactate (OMIM: 138790). Lactic acid is a microbial metabolite found in Aerococcus, Bacillus, Carnobacterium, Corynebacterium, Enterococcus, Escherichia, Lactobacillus, Lactococcus, Leuconostoc, Oenococcus, Pediococcus, Rhizopus, Saccharomyces, Streptococcus, Tetragenococcus, Vagococcus and Weissella (PMID:26287368; PMID:26360870).

   

cis-3-Chloroallyl aldehyde

cis-3-Chloroallyl aldehyde

C3H3ClO (89.9872)


This compound belongs to the family of Enolates. These are salts of enols (or of the tautomeric aldehydes or ketones), in which the anionic charge is delocalized over oxygen and carbon, or similar covalent metal derivatives in which the metal is bound to oxygen.

   

Sodium chlorite

Chlorous acid, sodium salt

ClNaO2 (89.9485)


Bleaching agent for starch; slimicide in the manuf. of paper and paperboard that contact food. It is used in processing waters for fruit, vegetables and red meats Sodium chlorite is a chemical compound used in the manufacture of paper. Bleaching agent for starch; slimicide in the manuf. of paper and paperboard that contact food. It is used in processing waters for fruit, vegetables and red meats D - Dermatologicals > D03 - Preparations for treatment of wounds and ulcers > D03A - Cicatrizants

   

Lactate

2-hydroxy-propionic acid

C3H6O3 (90.0317)


G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AD - Organic acids Lactate (Lactate acid) is the product of glycolysis. Lactate is produced by oxygen lack in contracting skeletal muscle in vivo, and can be removed under fully aerobic conditions. Lactate can be as a hemodynamic marker in the critically ill[1][2]. Lactate (Lactate acid) is the product of glycolysis. Lactate is produced by oxygen lack in contracting skeletal muscle in vivo, and can be removed under fully aerobic conditions. Lactate can be as a hemodynamic marker in the critically ill[1][2].

   

2-Methylthioacetaldehyde

(Methylthio)acetaldehyde

C3H6OS (90.0139)


   

Glycerose

α,β-Dihydroxypropionaldehyde

C3H6O3 (90.0317)


DL-Glyceraldehyde is a monosaccharide. DL-Glyceraldehyde is the simplest aldose. DL-Glyceraldehyde can be used for various biochemical studies[1].

   

Monoethyl carbonate

Carbonic acid monoethyl ester

C3H6O3 (90.0317)


Monoethyl carbonate is found in alcoholic beverages. Monoethyl carbonate is found in wine

   

(E)-1-Propene-1-sulfenic acid

(1E)-prop-1-ene-1-SO-thioperoxol

C3H6OS (90.0139)


(E)-1-Propene-1-sulfenic acid is found in onion-family vegetables. (E)-1-Propene-1-sulfenic acid is present in onion (Allium cepa Present in onion (Allium cepa). (E)-1-Propene-1-sulfenic acid is found in garden onion and onion-family vegetables.

   

S-Methyl thioacetate

Acetic acid, thio-, S-methyl ester

C3H6OS (90.0139)


S-Methyl thioacetate is found in alcoholic beverages. S-Methyl thioacetate is found in melon, strawberry, passion fruit, onion, cheese, cooked meats, beer, whiskies, wines and coffee. S-Methyl thioacetate is a flavouring agent Found in melon, strawberry, passion fruit, onion, cheese, cooked meats, beer, whiskies, wines and coffee. Flavouring agent

   

Dimethyl carbonate

Methyl carbonate, hexachloroantimonate (1-) (2:1)

C3H6O3 (90.0317)


Dimethyl carbonate is used for cold sterilisation of beverages. Effective against typical beverage-spoiling microorganisms, like yeasts and fermentative bacteria Dimethyl carbonate, often abbreviated DMC, is a flammable clear liquid boiling at 90 °C. It has recently found use as a methylating reagent. Its main benefit over other methylating reagents such as iodomethane and dimethyl sulfate is its lesser toxicity and its biodegradability. Also, it is now prepared from catalytic oxidative carbonylation of methanol with carbon monoxide and oxygen, instead of from phosgene making its production non-toxic and environmentally friendly. This allows dimethyl carbonate to be considered a green reagent

   

1-Mercapto-2-propanone

1-Sulphanylpropan-2-one

C3H6OS (90.0139)


1-Mercapto-2-propanone is found in animal foods. 1-Mercapto-2-propanone is present in pork volatiles. 1-Mercapto-2-propanone is used in roast pork flavour Present in pork volatiles. It is used in roast pork flavours. 1-Mercapto-2-propanone is found in animal foods.

   

(Methylthio)acetaldehyde

2-(Methylsulphanyl)acetaldehyde

C3H6OS (90.0139)


(Methylthio)acetaldehyde is a flavouring ingredien Flavouring ingredient

   

Methoxyacetic acid

Methoxyacetic acid (acd/name 4.0)

C3H6O3 (90.0317)


Methoxyacetic acid belongs to the family of Carboxylic Acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH. D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents Methoxyacetic acid is an endogenous metabolite.

   

1,2-Oxathiolane

1,2-Oxathiolane

C3H6OS (90.0139)


   

1,2,4-Trioxane

1,2,4-Trioxane

C3H6O3 (90.0317)


   

1,3,5-Trioxane

1,3,5-Trioxacyclohexane

C3H6O3 (90.0317)


   

Methyl ethaneperoxoate

Methyl ethaneperoxoic acid

C3H6O3 (90.0317)


   

Acryloyl chloride

prop-2-enoyl chloride

C3H3ClO (89.9872)


   

Dimethylnitramine

N,N-Dimethylnitroamine

C2H6N2O2 (90.0429)


   

Methanol, (methyl-ONN-azoxy)-

(hydroxymethyl)(methyl-oxo-λ⁵-azanylidene)amine

C2H6N2O2 (90.0429)


D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D013723 - Teratogens

   

N-METHYLTHIOUREA

N-Methylthiourea

C2H6N2S (90.0252)


   

Propanethioic acid

2-methylthioacetic acid

C3H6OS (90.0139)


   

Carbamimidothioic acid, methyl ester

S-Methylisothiopseudouronium monohydrochloride

C2H6N2S (90.0252)


   

allylsulfenate

prop-2-ene-1-SO-thioperoxol

C3H6OS (90.0139)


Allylsulfenate, also known as allylsulfenic acid or 2-propenesulfenic acid, is a member of the class of compounds known as allyl sulfur compounds. Allyl sulfur compounds are compounds containing an allylsulfur group, with the general structure H2C(=CH2)CS. Allylsulfenate is soluble (in water) and a very weakly acidic compound (based on its pKa). Allylsulfenate can be found in a number of food items such as wax gourd, acorn, pineappple sage, and calabash, which makes allylsulfenate a potential biomarker for the consumption of these food products.

   

D-(-)-Lactic acid

D-(−)-Lactic acid

C3H6O3 (90.0317)


Lactic acid, also known as lactate, plays several important biological roles in living organisms. Here are some of its key functions: Energy Production: Lactic acid is a crucial intermediate in the process of anaerobic glycolysis, which occurs in cells when oxygen is limited. During intense exercise, for example, muscle cells produce lactic acid as a byproduct of breaking down glucose for energy without using oxygen. This process helps sustain muscle activity when oxygen supply is insufficient. pH Regulation: Lactic acid serves as a pH buffer in the blood and other bodily fluids. It helps maintain the acid-base balance by accepting or donating hydrogen ions (H+), thereby preventing large fluctuations in pH that could be harmful to cellular processes. Hemoglobin Oxygen Release: Lactic acid can also influence the affinity of hemoglobin for oxygen. In tissues with high lactic acid concentrations (like exercising muscles), lactic acid binds to hemoglobin, causing a conformational change that promotes the release of oxygen. This is known as the Bohr effect. Cell Signaling: Lactate can act as a signaling molecule in various physiological processes. It has been shown to play a role in cell proliferation, inflammation, and immune response. Lactate can modulate the activity of immune cells and may contribute to the regulation of inflammation. Metabolic Regulation: Lactic acid is an important component in the metabolic network. It can be converted back into glucose in the liver through a process called gluconeogenesis, providing a source of energy for other tissues, including the brain, when carbohydrates are scarce. Antioxidant Properties: Lactic acid can function as an antioxidant, helping to protect cells from oxidative stress and damage caused by reactive oxygen species (ROS). Preservation of Foods: In food industry, lactic acid is used as a preservative due to its antimicrobial properties. It can inhibit the growth of bacteria and extend the shelf life of various food products.

   

lactic acid

DL-Lactic Acid

C3H6O3 (90.0317)


G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AD - Organic acids 2-hydroxypropanoic acid, also known as lactic acid or lactate, belongs to alpha hydroxy acids and derivatives class of compounds. Those are organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon. 2-hydroxypropanoic acid is soluble (in water) and a weakly acidic compound (based on its pKa). 2-hydroxypropanoic acid can be synthesized from propionic acid. 2-hydroxypropanoic acid is also a parent compound for other transformation products, including but not limited to, ethyl 2-hydroxypropanoate, 3-(imidazol-5-yl)lactic acid, and lactate ester. 2-hydroxypropanoic acid is an odorless tasting compound and can be found in a number of food items such as sunflower, potato, apple, and ginkgo nuts, which makes 2-hydroxypropanoic acid a potential biomarker for the consumption of these food products. 2-hydroxypropanoic acid is a drug which is used for use as an alkalinizing agent. In animals, L-lactate is constantly produced from pyruvate via the enzyme lactate dehydrogenase (LDH) in a process of fermentation during normal metabolism and exercise. It does not increase in concentration until the rate of lactate production exceeds the rate of lactate removal, which is governed by a number of factors, including monocarboxylate transporters, concentration and isoform of LDH, and oxidative capacity of tissues. The concentration of blood lactate is usually 1–2 mmol/L at rest, but can rise to over 20 mmol/L during intense exertion and as high as 25 mmol/L afterward . Lactate (Lactate acid) is the product of glycolysis. Lactate is produced by oxygen lack in contracting skeletal muscle in vivo, and can be removed under fully aerobic conditions. Lactate can be as a hemodynamic marker in the critically ill[1][2]. Lactate (Lactate acid) is the product of glycolysis. Lactate is produced by oxygen lack in contracting skeletal muscle in vivo, and can be removed under fully aerobic conditions. Lactate can be as a hemodynamic marker in the critically ill[1][2].

   

Dihydroxyacetone

1,3-Dihydroxyacetone

C3H6O3 (90.0317)


A ketotriose consisting of acetone bearing hydroxy substituents at positions 1 and 3. The simplest member of the class of ketoses and the parent of the class of glycerones. 1,3-Dihydroxyacetone (DHA), the main active ingredient in sunless tanning skin-care preparations and an important precursor for the synthesis of various fine chemicals, is produced on an industrial scale by microbial fermentation of glycerol over Gluconobacter oxydans[1]. 1,3-Dihydroxyacetone (DHA), the main active ingredient in sunless tanning skin-care preparations and an important precursor for the synthesis of various fine chemicals, is produced on an industrial scale by microbial fermentation of glycerol over Gluconobacter oxydans[1].

   

3-Chloroacrolein

3-chloroprop-2-enal

C3H3ClO (89.9872)


   

Acrylyl chloride

Acryloyl chloride

C3H3ClO (89.9872)


   

s-methylisothiourea

s-methylisothiourea

C2H6N2S (90.0252)


   

allylsulfenate

allylsulfenate

C3H6OS (90.0139)


   

Glyceraldehyde

DL-Glyceric aldehyde

C3H6O3 (90.0317)


An aldotriose comprising propanal having hydroxy groups at the 2- and 3-positions. It plays role in the formation of advanced glycation end-products (AGEs), a deleterious accompaniment to ageing. DL-Glyceraldehyde is a monosaccharide. DL-Glyceraldehyde is the simplest aldose. DL-Glyceraldehyde can be used for various biochemical studies[1].

   

Hydroxypropionic acid

3-Hydroxypropionic acid

C3H6O3 (90.0317)


A 3-hydroxy monocarboxylic acid that is propionic acid in which one of the hydrogens attached to the terminal carbon is replaced by a hydroxy group. Hydroxypropionic acid, also known as 3-hydroxypropionate or hydracrylic 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. Hydroxypropionic acid is soluble (in water) and a weakly acidic compound (based on its pKa). Hydroxypropionic acid can be synthesized from propionic acid. Hydroxypropionic acid is also a parent compound for other transformation products, including but not limited to, beta-propiolactone, ascr#5, and 3-hydroxypropanoyl-CoA. Hydroxypropionic acid can be found in a number of food items such as apple, poppy, yam, and cupuaçu, which makes hydroxypropionic acid a potential biomarker for the consumption of these food products. Hydroxypropionic acid can be found primarily in blood, cerebrospinal fluid (CSF), feces, and urine. Hydroxypropionic acid exists in all living organisms, ranging from bacteria to humans. In humans, hydroxypropionic acid is involved in the propanoate metabolism. Hydroxypropionic acid is also involved in few metabolic disorders, which include malonic aciduria, malonyl-coa decarboxylase deficiency, and methylmalonic aciduria due to cobalamin-related disorders. Moreover, hydroxypropionic acid is found to be associated with biotinidase deficiency and propionic acidemia. Hydroxypropionic acid is a non-carcinogenic (not listed by IARC) potentially toxic compound. Hydroxypropanoic acid, or alternately hydroxypropionic acid, may refer to either of two isomeric chemical compounds: 3-Hydroxypropionic acid (hydracrylic acid) Lactic acid (2-hydroxypropanoic acid) . Chronically high levels of hydroxypropionic acid are associated with at least 5 inborn errors of metabolism including: Biotinidase deficiency, Malonic Aciduria, Methylmalonate Semialdehyde Dehydrogenase Deficiency, Methylmalonic Aciduria, Methylmalonic, Aciduria Due to Cobalamin-Related Disorders and Propionic acidemia (T3DB).

   

D-Lactic acid

D-(−)-Lactic acid

C3H6O3 (90.0317)


   

oxalic acid

oxalic acid

C2H2O4 (89.9953)


An alpha,omega-dicarboxylic acid that is ethane substituted by carboxyl groups at positions 1 and 2. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019163 - Reducing Agents Oxalic Acid is a strong dicarboxylic acid occurring in many plants and vegetables and can be used as an analytical reagent and general reducing agent. Oxalic Acid is a strong dicarboxylic acid occurring in many plants and vegetables and can be used as an analytical reagent and general reducing agent.

   

3-Hydroxypropanoic acid

3-Hydroxypropanoic acid

C3H6O3 (90.0317)


   

L-Lactic acid

Lactic Acid, L-

C3H6O3 (90.0317)


L-Lactic acid is a buildiing block which can be used as a precursor for the production of the bioplastic polymer poly-lactic acid. L-Lactic acid is a buildiing block which can be used as a precursor for the production of the bioplastic polymer poly-lactic acid.

   

(S)-Lactate

(S)-Lactate

C3H6O3 (90.0317)


   

Lactic acid; LC-tDDA; CE10

Lactic acid; LC-tDDA; CE10

C3H6O3 (90.0317)


   

Lactic acid; LC-tDDA; CE20

Lactic acid; LC-tDDA; CE20

C3H6O3 (90.0317)


   

Lactic acid; LC-tDDA; CE30

Lactic acid; LC-tDDA; CE30

C3H6O3 (90.0317)


   

Lactic acid; LC-tDDA; CE40

Lactic acid; LC-tDDA; CE40

C3H6O3 (90.0317)


   

Oxalate

Oxalate

C2H2O4 (89.9953)


   

3-Hydroxypropionic acid

3-Hydroxypropionic acid

C3H6O3 (90.0317)


   

S-Methyl isothiourea

Methyl carbamimidothioate, hemisulfate

C2H6N2S (90.0252)


   

Methyl carbonate

Dimethyl carbonate [UN1161] [Flammable liquid]

C3H6O3 (90.0317)


   

Mercaptoacetone

1-mercapto-2-propanone

C3H6OS (90.0139)


   

Methylthioacetate

Acetic acid, thio-, S-methyl ester

C3H6OS (90.0139)


   

Etabonic acid

Carbonic acid monoethyl ester

C3H6O3 (90.0317)


   

(E)-1-Propene-1-sulfenic acid

(1E)-prop-1-ene-1-SO-thioperoxol

C3H6OS (90.0139)


   

FEMA 3206

2-(Methylsulfanyl)acetaldehyde

C3H6OS (90.0139)


   

Methoxyacetic acid

Methoxyacetic acid (acd/name 4.0)

C3H6O3 (90.0317)


D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents Methoxyacetic acid is an endogenous metabolite.

   

Urea formaldehyde

Urea formaldehyde

C2H6N2O2 (90.0429)


   

3-Chloro-1-butene

3-Chloro-1-butene

C4H7Cl (90.0236)


   

thietan-3-ol

thietan-3-ol

C3H6OS (90.0139)


   

1,2-Ethanediol,1-formate

1,2-Ethanediol,1-formate

C3H6O3 (90.0317)


   

2-Chloro-2-butene

2-Chloro-2-butene

C4H7Cl (90.0236)


   

2-hydroxyacetohydrazide

2-hydroxyacetohydrazide

C2H6N2O2 (90.0429)


   

2-Fluoroacrylic acid

2-Fluoroacrylic acid

C3H3FO2 (90.0117)


   

1-Chloro-2-butene

1-Chloro-2-butene

C4H7Cl (90.0236)


   

Methyl carbazate

Methyl carbazate

C2H6N2O2 (90.0429)


   

Silicic acid, lithiumsalt suppliers in China

Silicic acid, lithiumsalt suppliers in China

Li2O3Si (89.9937)


   

N-Methylthiourea

N-Methylthiourea

C2H6N2S (90.0252)


A member of the class of thioureas that is thiourea in which one of the hydrogens is replaced by a methyl group.

   

(Chloromethyl)cyclopropane

(Chloromethyl)cyclopropane

C4H7Cl (90.0236)


   

Methyl glycolate

Methyl glycolate

C3H6O3 (90.0317)


   

Imidazole, sodium derivative

Imidazole, sodium derivative

C3H3N2Na (90.0194)


   

Carbonic Acid Di(Methyl-D3) Ester

Carbonic Acid Di(Methyl-D3) Ester

C3H6O3 (90.0317)


   

4-Chloro-1-Butene

1-Butene, 4-chloro-

C4H7Cl (90.0236)


   

(Z)-14-METHYL-8-HEXADECEN-1-AL

(Z)-14-METHYL-8-HEXADECEN-1-AL

C4H7Cl (90.0236)


   

2-thienyllithium

2-thienyllithium

C4H3LiS (90.0116)


   

POLY(UREA-CO-FORMALDEHYDE), BUTYLATED

POLY(UREA-CO-FORMALDEHYDE), BUTYLATED

C2H6N2O2 (90.0429)


   

1-chlorobut-1-ene

1-chlorobut-1-ene

C4H7Cl (90.0236)


   

Chlorocyclobutane

Chlorocyclobutane

C4H7Cl (90.0236)


   

2-chloro-1-butene

2-chloro-1-butene

C4H7Cl (90.0236)


   

POLY(UREA-CO-FORMALDEHYDE), METHYLATED

POLY(UREA-CO-FORMALDEHYDE), METHYLATED

C2H6N2O2 (90.0429)


   

Propanethioic acid

Propanethioicacid (9CI)

C3H6OS (90.0139)


   

1-chloro-1-butene

1-chloro-1-butene

C4H7Cl (90.0236)


   

lithium silicate

lithium silicate

Li2O3Si (89.9937)


   

1,3,5-trioxane

1,3,5-trioxane

C3H6O3 (90.0317)


   

2-hydroxypropionic acid

2-hydroxypropionic acid

C3H6O3 (90.0317)


   

2,n-dihydroxy-acetamidine

2,n-dihydroxy-acetamidine

C2H6N2O2 (90.0429)


   

Methyl Vinyl sulphone

Methyl Vinyl sulphone

C3H6OS (90.0139)


   

3-Hydroxypropanoic acid ion

3-Hydroxypropanoic acid ion

C3H6O3 (90.0317)


   

trisilirane

trisilirane

H6Si3 (89.9777)


   
   

Urea - formaldehyde (1:1)

Urea - formaldehyde (1:1)

C2H6N2O2 (90.0429)


   

Poly(formaldehyde-urea)

Poly(formaldehyde-urea)

C2H6N2O2 (90.0429)


   

(E)-1-Chlorobut-2-ene

(E)-1-Chlorobut-2-ene

C4H7Cl (90.0236)


   

Hypodiboric acid

Tetrahydroxydiboron

H4B2O4 (90.0296)


   

1,1-Dihydroxypropan-2-one

1,1-Dihydroxypropan-2-one

C3H6O3 (90.0317)


   

Methylene glycol monoacetate

Methylene glycol monoacetate

C3H6O3 (90.0317)


   

Carbamimidothioic acid, methyl ester

Carbamimidothioic acid, methyl ester

C2H6N2S (90.0252)


D004791 - Enzyme Inhibitors

   

Acetamide, 2-amino-N-hydroxy-

Acetamide, 2-amino-N-hydroxy-

C2H6N2O2 (90.0429)


   

methyl thioacetate

S-Methyl thioacetate

C3H6OS (90.0139)


   

Thioglycolate(2-)

Thioglycolate(2-)

C2H2O2S-2 (89.9776)


   

Tetrafluoroammonium

Tetrafluoroammonium

F4N+ (89.9967)


   

93578_FLUKA

Propanoic acid, 2-hydroxy-, (2R)-

C3H6O3 (90.0317)


   

Soleal

4-01-00-04119 (Beilstein Handbook Reference)

C3H6O3 (90.0317)


1,3-Dihydroxyacetone (DHA), the main active ingredient in sunless tanning skin-care preparations and an important precursor for the synthesis of various fine chemicals, is produced on an industrial scale by microbial fermentation of glycerol over Gluconobacter oxydans[1]. 1,3-Dihydroxyacetone (DHA), the main active ingredient in sunless tanning skin-care preparations and an important precursor for the synthesis of various fine chemicals, is produced on an industrial scale by microbial fermentation of glycerol over Gluconobacter oxydans[1].

   

(Aminooxy)acetate

(Aminooxy)acetate

C2H4NO3- (90.0191)


D018377 - Neurotransmitter Agents > D018682 - GABA Agents D004791 - Enzyme Inhibitors

   

CID 12949431

CID 12949431

C2H4NO3- (90.0191)


   

Deuterio 3,3-dideuterio-2-fluoroprop-2-enoate

Deuterio 3,3-dideuterio-2-fluoroprop-2-enoate

C3H3FO2 (90.0117)


   

CID 166451857

CID 166451857

C2H2O4-2 (89.9953)


   

Sodium chlorite

Sodium chlorite

ClNaO2 (89.9485)


D - Dermatologicals > D03 - Preparations for treatment of wounds and ulcers > D03A - Cicatrizants

   

D-Glyceraldehyde

D-(+)-Glyceraldehyde

C3H6O3 (90.0317)


The D-enantiomer of glyceraldehyde.

   

1-sulfinylpropane

Propanethial S-oxide, (1Z)-

C3H6OS (90.0139)


   

L-glyceraldehyde

D-(+)-Glyceraldehyde

C3H6O3 (90.0317)


The L-enantiomer of glyceraldehyde.

   

Methoxyacetic acid

2-Methoxyacetic acid

C3H6O3 (90.0317)


A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens is replaced by a methoxy group. D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents Methoxyacetic acid is an endogenous metabolite.

   

S-allylsulfenic acid

S-allylsulfenic acid

C3H6OS (90.0139)


An S-alkylsulfenic acid in which the alkyl group is specified as allyl.

   

trioxane

1,3,5-trioxane

C3H6O3 (90.0317)


   

1-mercapto-2-propanone

1-mercapto-2-propanone

C3H6OS (90.0139)


   

Dimethyl Carbonate

Dimethyl Carbonate

C3H6O3 (90.0317)


   

Ethyl hydrogen carbonate

Ethyl hydrogen carbonate

C3H6O3 (90.0317)


   

cis-3-Chloroallyl aldehyde

cis-3-Chloroallyl aldehyde

C3H3ClO (89.9872)


   

Hydroxymethylimino-methyl-oxidoazanium

Hydroxymethylimino-methyl-oxidoazanium

C2H6N2O2 (90.0429)


D009676 - Noxae > D000477 - Alkylating Agents D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D013723 - Teratogens

   

rac-lactic acid

rac-lactic acid

C3H6O3 (90.0317)


A racemate comprising equimolar amounts of (R)- and (S)-lactic acid.

   

(Z)-propanethial S-oxide

(Z)-propanethial S-oxide

C3H6OS (90.0139)


A propanethial S-oxide in which the double bond adopts a Z-configuration.

   

(E)-propanethial S-oxide

(E)-propanethial S-oxide

C3H6OS (90.0139)


A propanethial S-oxide in which the double bond adopts an E-configuration.

   

(R)-Lactic acid

(R)-Lactic acid

C3H6O3 (90.0317)


An optically active form of lactic acid having (R)-configuration.

   

(S)-Lactic acid

(S)-Lactic acid

C3H6O3 (90.0317)


An optically active form of lactic acid having (S)-configuration.

   

2-Hydroxypropanoic acid

2-Hydroxypropanoic acid

C3H6O3 (90.0317)


A 2-hydroxy monocarboxylic acid that is propanoic acid in which one of the alpha-hydrogens is replaced by a hydroxy group.

   

Propanethial S-oxide

Propanethial S-oxide

C3H6OS (90.0139)


A thiocarbonyl compound that is propanethial in which the sulfur atom carries an oxo group. It is a lachrymatory factor found in onions.

   

1-oxide thietane

NA

C3H6OS (90.0139)


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