Exact Mass: 119.0820486

Exact Mass Matches: 119.0820486

Found 286 metabolites which its exact mass value is equals to given mass value 119.0820486, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

L-Threonine

(2S,3R)-2-amino-3-hydroxybutanoic acid

C4H9NO3 (119.0582404)


L-threonine is an optically active form of threonine having L-configuration. It has a role as a nutraceutical, a micronutrient, a Saccharomyces cerevisiae metabolite, a plant metabolite, an Escherichia coli metabolite, a human metabolite, an algal metabolite and a mouse metabolite. It is an aspartate family amino acid, a proteinogenic amino acid, a threonine and a L-alpha-amino acid. It is a conjugate base of a L-threoninium. It is a conjugate acid of a L-threoninate. It is an enantiomer of a D-threonine. It is a tautomer of a L-threonine zwitterion. An essential amino acid occurring naturally in the L-form, which is the active form. It is found in eggs, milk, gelatin, and other proteins. L-Threonine is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Threonine is an essential amino acid in humans (provided by food), Threonine is an important residue of many proteins, such as tooth enamel, collagen, and elastin. An important amino acid for the nervous system, threonine also plays an important role in porphyrin and fat metabolism and prevents fat buildup in the liver. Useful with intestinal disorders and indigestion, threonine has also been used to alleviate anxiety and mild depression. (NCI04) Threonine is an essential amino acid in humans. It is abundant in human plasma, particularly in newborns. Severe deficiency of threonine causes neurological dysfunction and lameness in experimental animals. Threonine is an immunostimulant which promotes the growth of thymus gland. It also can probably promote cell immune defense function. This amino acid has been useful in the treatment of genetic spasticity disorders and multiple sclerosis at a dose of 1 gram daily. It is highly concentrated in meat products, cottage cheese and wheat germ. The threonine content of most of the infant formulas currently on the market is approximately 20\\\\\\% higher than the threonine concentration in human milk. Due to this high threonine content the plasma threonine concentrations are up to twice as high in premature infants fed these formulas than in infants fed human milk. The whey proteins which are used for infant formulas are sweet whey proteins. Sweet whey results from cheese production. Threonine catabolism in mammals appears to be due primarily (70-80\\\\\\%) to the activity of threonine dehydrogenase (EC 1.1.1.103) that oxidizes threonine to 2-amino-3-oxobutyrate, which forms glycine and acetyl CoA, whereas threonine dehydratase (EC 4.2.1.16) that catabolizes threonine into 2-oxobutyrate and ammonia, is significantly less active. Increasing the threonine plasma concentrations leads to accumulation of threonine and glycine in the brain. Such accumulation affects the neurotransmitter balance which may have consequences for the brain development during early postnatal life. Thus, excessive threonine intake during infant feeding should be avoided. (A3450). An essential amino acid occurring naturally in the L-form, which is the active form. It is found in eggs, milk, gelatin, and other proteins. See also: Amlisimod (monomer of) ... View More ... Threonine (Thr) or L-threonine is an alpha-amino acid. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Amino acids are organic compounds that contain amino (–NH2) and carboxyl (–COOH) functional groups, along with a side chain (R group) specific to each amino acid. L-threonine is one of 20 proteinogenic amino acids, i.e., the amino acids used in the biosynthesis of proteins. Threonine is found in all organisms ranging from bacteria to plants to animals. It is classified as a polar, uncharged (at physiological pH), aliphatic amino acid. Threonine is sometimes considered as a branched chain amino acid. Threonine was actually the last of the 20 amino acids to be discovered (in 1938). It was named threonine because it was similar in structure to threonic acid, a four-carbon monosaccharide. Threonine is an essential amino acid in humans, meaning the body cannot synthesize it and that it must be obtained from the diet. Foods high in threonine include cottage cheese, poultry, fish, meat, lentils, black turtle bean and sesame seeds. Adult humans require about 20 mg/kg body weight/day. In plants and microorganisms, threonine is synthesized from aspartic acid via alpha-aspartyl-semialdehyde and homoserine. In proteins, the threonine residue is susceptible to numerous posttranslational modifications. The hydroxyl side-chain can undergo O-linked glycosylation and phosphorylation through the action of a threonine kinase. Threonine is abundant in human plasma, particularly in newborns. Severe deficiency of threonine causes neurological dysfunction and lameness in experimental animals. Threonine is an immunostimulant which promotes the growth of thymus gland. It also can probably promote cell immune defense function. The threonine content of most of the infant formulas currently on the market is approximately 20\\\\\\% higher than the threonine concentration in human milk. Due to this high threonine content the plasma threonine concentrations are up to twice as high in premature infants fed these formulas than in infants fed human milk. The whey proteins which are used for infant formulas are sweet whey proteins. Sweet whey results from cheese production. Increasing the threonine plasma concentrations leads to accumulation of threonine and glycine in the brain. Such accumulation affects the neurotransmitter balance which may have consequences for the brain development during early postnatal life. Thus, excessive threonine intake during infant feeding should be avoided. (PMID 9853925). Threonine is metabolized in at least two ways. In many animals it is converted to pyruvate via threonine dehydrogenase. An intermediate in this pathway can undergo thiolysis with CoA to produce acetyl-CoA and glycine. In humans the gene for threonine dehydrogenase is an inactive pseudogene, so threonine is converted to alpha-ketobutyrate. From wide variety of protein hydrolysates. Dietary supplement, nutrient L-Threonine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=72-19-5 (retrieved 2024-07-01) (CAS RN: 72-19-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). DL-Threonine, an essential amino acid, has the potential to treat hypostatic leg ulceration[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1].

   

L-Homoserine

(2S)-2-Amino-4-hydroxybutanoic acid

C4H9NO3 (119.0582404)


L-homoserine, also known as 2-amino-4-hydroxybutanoic acid or isothreonine, is a member of the class of compounds known as L-alpha-amino acids. L-alpha-amino acids are alpha amino acids which have the L-configuration of the alpha-carbon atom. L-homoserine is soluble (in water) and a moderately acidic compound (based on its pKa). L-homoserine can be found in common pea, which makes L-homoserine a potential biomarker for the consumption of this food product. L-homoserine can be found primarily in blood, feces, and urine, as well as in human prostate tissue. L-homoserine exists in all living species, ranging from bacteria to humans. In humans, L-homoserine is involved in the methionine metabolism. L-homoserine is also involved in several metabolic disorders, some of which include glycine n-methyltransferase deficiency, hypermethioninemia, cystathionine beta-synthase deficiency, and methylenetetrahydrofolate reductase deficiency (MTHFRD). Homoserine (also called isothreonine) is an α-amino acid with the chemical formula HO2CCH(NH2)CH2CH2OH. L-Homoserine is not one of the common amino acids encoded by DNA. It differs from the proteinogenic amino acid serine by insertion of an additional -CH2- unit into the backbone. Homoserine, or its lactone form, is the product of a cyanogen bromide cleavage of a peptide by degradation of methionine . Homoserine is a more reactive variant of the amino acid serine. In this variant, the hydroxyl side chain contains an additional CH2 group which brings the hydroxyl group closer to its own carboxyl group, allowing it to chemically react to form a five-membered ring. This occurs at the point that amino acids normally join to their neighbours in a peptide bond. Homoserine is therefore unsuitable for forming proteins and has been eliminated from the repertoire of amino acids used by living things. Homoserine is the final product on the C-terminal end of the N-terminal fragment following a cyanogen bromide cleavage. (wikipedia). Homoserine is also a microbial metabolite. L-Homoserine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=672-15-1 (retrieved 2024-07-02) (CAS RN: 672-15-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). L-Homoserine is a non - protein amino acid, which is an important biosynthetic intermediate of threonine, methionine and lysine. L-Homoserine is a non - protein amino acid, which is an important biosynthetic intermediate of threonine, methionine and lysine.

   

2-Methylserine

alpha-Methyl-DL-serine

C4H9NO3 (119.0582404)


Acquisition and generation of the data is financially supported in part by CREST/JST. KEIO_ID M025

   

S-acetylcysteamine

S-Acetylthioethanolamine

C4H9NOS (119.0404824)


   

4-Amino-3-hydroxybutyrate

4-Amino-3-hydroxybutyric acid, (Z)-2-butenedioate salt (2:1), (+-)-isomer

C4H9NO3 (119.0582404)


4-Amino-3-hydroxybutyrate belongs to the class of organic compounds known as hydroxy fatty acids. These are fatty acids in which the chain bears a hydroxyl group.

   

2,3-dihydroxybutanamide

(-)-erythro-(2R,3R)-Dihydroxybutylamide

C4H9NO3 (119.0582404)


   

L-Allothreonine

(2S,3S)-2-Amino-3-hydroxybutanoic acid

C4H9NO3 (119.0582404)


L-allothreonine is the L-enantiomer of allothreonine. It has a role as an Escherichia coli metabolite and a Saccharomyces cerevisiae metabolite. It is an enantiomer of a D-allothreonine. It is a tautomer of a L-allothreonine zwitterion. Allothreonine is the substrate of the enzyme Serine hydroxymethyltransferase1 (SHMT, EC 2.1.2.1), a human cytoplasmic mRNA binding protein. SHMT uses pyridoxal 5-phosphate (PLP) and tetrahydropteroylglutamate (H4PteGlu) as coenzymes and catalyzes the reversible interconversion of serine and glycine. In addition to these physiological reactions, SHMT also catalyzes, in the absence of H4PteGlu, the retroaldol cleavage of several 3-hydroxyamino acids, such as allothreonine. Allothreonine is a plant metabolite that appears in the human diet in variable concentrations depending on: plant species, physiological changes during plant growth, senescence, and reactions to environmental stress or to changes due to plant transformation (PMID:10858298, 10952545). Allothreonine is the substrate of the enzyme Serine hydroxymethyltransferase1 (SHMT, EC 2.1.2.1), a human cytoplasmic mRNA binding protein. SHMT uses pyridoxal 5-phosphate (PLP) and tetrahydropteroylglutamate (H4PteGlu) as coenzymes and catalyzes the reversible interconversion of serine and glycine. In addition to these physiological reactions, SHMT also catalyzes, in the absence of H4PteGlu, the retroaldol cleavage of several 3-hydroxyamino acids, such as allothreonine. Allothreonine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=144-98-9 (retrieved 2024-07-15) (CAS RN: 144-98-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). D-Allothreonine is the D type stereoisomer of Allothreonine. D-Allothreonine is a peptido-lipid derived from bacteria. D-Allothreonine, amide-linked to the D-galacturonic acid, is also a constituent in the polysaccharide[1][2]. L-Allothreonine (H-allo-Thr-OH) is an endogenous metabolite.

   

L-Threonine

D-(+)-Threonine

C4H9NO3 (119.0582404)


An optically active form of threonine having L-configuration. MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; AYFVYJQAPQTCCC_STSL_0105_Threonine_8000fmol_180506_S2_LC02_MS02_275; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. CONFIDENCE standard compound; INTERNAL_ID 10 DL-Threonine, an essential amino acid, has the potential to treat hypostatic leg ulceration[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1].

   
   

Threonine #

(s)-threonine;L-alpha-Amino-beta-hydroxybutyric acid;l-threonin;Threonin

C4H9NO3 (119.0582404)


2-amino-3-hydroxybutanoic acid is an alpha-amino acid that is butanoic acid substituted by an amino group at position 2 and a hydroxy group at position 3. It has a role as a plant metabolite. An alpha-amino acid that is butanoic acid substituted by an amino group at position 2 and a hydroxy group at position 3. D-Allothreonine is the D type stereoisomer of Allothreonine. D-Allothreonine is a peptido-lipid derived from bacteria. D-Allothreonine, amide-linked to the D-galacturonic acid, is also a constituent in the polysaccharide[1][2]. DL-Threonine, an essential amino acid, has the potential to treat hypostatic leg ulceration[1]. L-Allothreonine (H-allo-Thr-OH) is an endogenous metabolite. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1].

   

Aminoethoxyacetic acid

2-(2-Aminoethoxy)acetic acid

C4H9NO3 (119.0582404)


Aminoethoxyacetic acid is a metabolite of linezolid. Linezolid is a synthetic antibiotic used for the treatment of serious infections caused by Gram-positive bacteria that are resistant to several other antibiotics. A member of the oxazolidinone class of drugs, linezolid is active against most Gram-positive bacteria that cause disease, including streptococci, vancomycin-resistant enterococci (VRE), and methicillin-resistant Staphylococcus aureus (MRSA). (Wikipedia)

   

Hydroxyethyl glycine

2-hydroxyethyl 2-aminoacetate

C4H9NO3 (119.0582404)


Hydroxyethyl glycine is a metabolite of linezolid. Linezolid is a synthetic antibiotic used for the treatment of serious infections caused by Gram-positive bacteria that are resistant to several other antibiotics. A member of the oxazolidinone class of drugs, linezolid is active against most Gram-positive bacteria that cause disease, including streptococci, vancomycin-resistant enterococci (VRE), and methicillin-resistant Staphylococcus aureus (MRSA). (Wikipedia)

   

1,2-Diacylglycerol-LD-PI-pool

Phenyl isocyanate, 14C-labeled CPD

C7H5NO (119.03711200000001)


1,2-Diacylglycerol-LD-PI-pool, also known as PI or Carba0, is classified as a benzene or a Benzene derivative. Benzenes are aromatic compounds containing one monocyclic ring system consisting of benzene. 1,2-Diacylglycerol-LD-PI-pool is considered to be practically insoluble (in water) and basic. 1,2-Diacylglycerol-LD-PI-pool is a non-carcinogenic (not listed by IARC) potentially toxic compound

   

1,2-Benzisoxazole

1-Oxa-2-aza-1H-indene

C7H5NO (119.03711200000001)


   

1H-Benzotriazole

1,2,3-Triaza-1H-indene

C6H5N3 (119.04834500000001)


   
   

2-Mercaptoethylguanidine

2-Mercaptoethylguanidine, sulfate(2:1) salt

C3H9N3S (119.0517154)


D004791 - Enzyme Inhibitors

   

Serine methyl ester

methyl 2-amino-3-hydroxypropanoate

C4H9NO3 (119.0582404)


   

1-(2-Aminoethyl)thiourea

1-(2-Aminoethyl)thiourea

C3H9N3S (119.0517154)


   

4-Azabenzimidazole

3H-Imidazo[4,5-b]pyridine

C6H5N3 (119.04834500000001)


   
   

5H-Pyrrolo[3,2-d]pyrimidine

5H-Pyrrolo[3,2-d]pyrimidine

C6H5N3 (119.04834500000001)


   

2-Aminoethyl carbamimidothioate

Carbamimidothioic acid, 2-aminoethyl ester, dihydrobromide

C3H9N3S (119.0517154)


D020011 - Protective Agents > D011837 - Radiation-Protective Agents

   

Benzoxazole

1-Oxa-3-aza-1H-indene

C7H5NO (119.03711200000001)


Benzoxazole, also known as 1-oxa-3-aza-1h-indene, is a member of the class of compounds known as benzoxazoles. Benzoxazoles are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively. Benzoxazole is soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Benzoxazole can be found in tea, which makes benzoxazole a potential biomarker for the consumption of this food product. Being a heterocyclic compound, benzoxazole finds use in research as a starting material for the synthesis of larger, usually bioactive structures. Its aromaticity makes it relatively stable, although as a heterocycle, it has reactive sites which allow for functionalization .

   

D-beta-Homoserine

3-amino-4-Hydroxybutyric acid, (+-)-isomer

C4H9NO3 (119.0582404)


   

D-Threonine

alpha-Amino-beta-hydroxybutyric acid

C4H9NO3 (119.0582404)


Alpha-amino-beta-hydroxybutyric acid, also known as α-amino-β-hydroxybutyrate, is a member of the class of compounds known as alpha amino acids. Alpha amino acids are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Alpha-amino-beta-hydroxybutyric acid is soluble (in water) and a moderately acidic compound (based on its pKa). Alpha-amino-beta-hydroxybutyric acid can be found in peanut, which makes alpha-amino-beta-hydroxybutyric acid a potential biomarker for the consumption of this food product.

   
   
   

Indoline

2,3-dihydro-1H-Indole

C8H9N (119.0734954)


indoline, also known as dihydroindole, belongs to the class of organic compounds known as indolines. Indolines are compounds containing an indole moiety, which consists of pyrrolidine ring fused to benzene to form 2,3-dihydroindole. Indoline is an aromatic heterocyclic organic compound with the chemical formula C8H9N. The compound is based on the indole structure, but the 2-3 bond is saturated. indoline is a strong basic compound (based on its pKa). By oxidation/dehydrogenation it can be converted to indoles. It has a bicyclic structure, consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing ring. Indoline was used to make Indocaine. This compound has been identified in human blood as reported by (PMID: 31557052 ). Indoline is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically Indoline is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.

   

Isoindoline

2,3-dihydro-1H-isoindole

C8H9N (119.0734954)


   

N-Acetylcysteamine

Thiol N-acetyl-beta-mercaptoethylamine

C4H9NOS (119.0404824)


   

N,N-Dimethylformamide dimethyl acetal

Dimethylformamide-dimethylacetal, 14C-labeled

C5H13NO2 (119.0946238)


   

Phenacyl

2-oxo-2-phenylethyl

C8H7O (119.04968720000001)


   
   

(2S)-2-Amino-4-sulfanylbutanal

(2S)-2-Amino-4-sulphanylbutanal

C4H9NOS (119.0404824)


   

3-dimethylsulfoniopropionaldehyde

3-Dimethylsulphoniopropionaldehyde

C5H11OS (119.0530576)


3-dimethylsulfoniopropionaldehyde, also known as dmsp-aldehyde, is a member of the class of compounds known as alpha-hydrogen aldehydes. Alpha-hydrogen aldehydes are aldehydes with the general formula HC(H)(R)C(=O)H, where R is an organyl group. 3-dimethylsulfoniopropionaldehyde is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). 3-dimethylsulfoniopropionaldehyde can be found in a number of food items such as chinese chestnut, welsh onion, dandelion, and parsnip, which makes 3-dimethylsulfoniopropionaldehyde a potential biomarker for the consumption of these food products.

   

N-hydroxycadaverine

N-(5-azaniumylpentyl)hydroxylamine

C5H15N2O+ (119.118432)


N-hydroxycadaverine is also known as N-hydroxypentane-1,5-diamine or 1-amino-5-hydroxyaminopentane. N-hydroxycadaverine is soluble (in water) and an extremely weak acidic compound (based on its pKa). N-hydroxycadaverine can be found in a number of food items such as pepper (spice), pistachio, radish (variety), and tinda, which makes N-hydroxycadaverine a potential biomarker for the consumption of these food products.

   

Threonine

L-THREONINE, [U-14C]

C4H9NO3 (119.0582404)


COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS DL-Threonine, an essential amino acid, has the potential to treat hypostatic leg ulceration[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1].

   

1H-Benzotriazole

1,2,3-BENZOTRIAZOLE

C6H5N3 (119.04834500000001)


CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2978; ORIGINAL_PRECURSOR_SCAN_NO 2976 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2990; ORIGINAL_PRECURSOR_SCAN_NO 2988 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2960; ORIGINAL_PRECURSOR_SCAN_NO 2958 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2969; ORIGINAL_PRECURSOR_SCAN_NO 2967 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6248; ORIGINAL_PRECURSOR_SCAN_NO 6246 ORIGINAL_ACQUISITION_NO 6248; ORIGINAL_PRECURSOR_SCAN_NO 6246; CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6290; ORIGINAL_PRECURSOR_SCAN_NO 6288 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6292; ORIGINAL_PRECURSOR_SCAN_NO 6290 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6308; ORIGINAL_PRECURSOR_SCAN_NO 6305 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6318; ORIGINAL_PRECURSOR_SCAN_NO 6317 CONFIDENCE standard compound; INTERNAL_ID 634; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6317; ORIGINAL_PRECURSOR_SCAN_NO 6314 CONFIDENCE standard compound; INTERNAL_ID 2414 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 1078 CONFIDENCE standard compound; INTERNAL_ID 4050 CONFIDENCE standard compound; INTERNAL_ID 4177 CONFIDENCE standard compound; INTERNAL_ID 8197 CONFIDENCE standard compound; EAWAG_UCHEM_ID 166

   

Indoline

Indoline

C8H9N (119.0734954)


CONFIDENCE standard compound; INTERNAL_ID 8360

   

n-methyl-dl-serine

n-methyl-dl-serine

C4H9NO3 (119.0582404)


   

3-Amino-4-hydroxybutyric acid

3-Amino-4-hydroxybutyric acid

C4H9NO3 (119.0582404)


   

ethyl amino-hydroxyacetate

ethyl amino-hydroxyacetate

C4H9NO3 (119.0582404)


   

3-(methylthio)propanamide

3-(methylthio)propanamide

C4H9NOS (119.0404824)


   

6,7-dihydro-5H-cyclopenta[c]pyridine

6,7-dihydro-5H-cyclopenta[c]pyridine

C8H9N (119.0734954)


   

Nitrile-4-Hydroxybenzoic acid

Nitrile-4-Hydroxybenzoic acid

C7H5NO (119.03711200000001)


   

2-amino-3,4-dihydroxybutanal

2-amino-3,4-dihydroxybutanal

C4H9NO3 (119.0582404)


   

Nitrile-3-Hydroxybenzoic acid

Nitrile-3-Hydroxybenzoic acid

C7H5NO (119.03711200000001)


   

2,3-Cyclopentenopyridine

2,3-Cyclopentenopyridine

C8H9N (119.0734954)


   

2-((2-Hydroxyethyl)amino)acetic acid

2-((2-Hydroxyethyl)amino)acetic acid

C4H9NO3 (119.0582404)


   

Anthranil

2,1-benzoxazole

C7H5NO (119.03711200000001)


   

3-dimethylsulfoniopropionaldehyde

3-dimethylsulfoniopropionaldehyde

C5H11OS+ (119.0530576)


A sulfonium compound that is dimethysulfonium with a 3-oxopropyl substituent.

   

Benzotriazole

1H-Benzotriazole

C6H5N3 (119.04834500000001)


CONFIDENCE standard compound; INTERNAL_ID 2 CONFIDENCE standard compound; INTERNAL_ID 8799 CONFIDENCE Reference Standard (Level 1)

   

Threonine

L-Threonine

C4H9NO3 (119.0582404)


An alpha-amino acid in which one of the hydrogens attached to the alpha-carbon of glycine is substituted by a 1-hydroxyethyl group. Acquisition and generation of the data is financially supported by the Max-Planck-Society L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1]. L-Threonine is a natural amino acid, can be produced by microbial fermentation, and is used in food, medicine, or feed[1].

   

L-β-homoserine

(3R)-3-amino-4-hydroxybutanoic acid

C4H9NO3 (119.0582404)


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

   

D-β-homoserine

D-beta-Homoserine

C4H9NO3 (119.0582404)


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

   

Homoserine

dl -homoserine

C4H9NO3 (119.0582404)


An alpha-amino acid that is glycine substituted at the alpha-position by a 2-hydroxyethyl group. Homoserine, also known as L-isomer of homoserine or 2-amino-4-hydroxybutanoic acid, is a member of the class of compounds known as alpha amino acids. Alpha amino acids are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Homoserine is soluble (in water) and a moderately acidic compound (based on its pKa). Homoserine can be found in common pea and ginkgo nuts, which makes homoserine a potential biomarker for the consumption of these food products. Homoserine (also called isothreonine) is an α-amino acid with the chemical formula HO2CCH(NH2)CH2CH2OH. L-Homoserine is not one of the common amino acids encoded by DNA. It differs from the proteinogenic amino acid serine by insertion of an additional -CH2- unit into the backbone. Homoserine, or its lactone form, is the product of a cyanogen bromide cleavage of a peptide by degradation of methionine . L-Homoserine is a non - protein amino acid, which is an important biosynthetic intermediate of threonine, methionine and lysine. L-Homoserine is a non - protein amino acid, which is an important biosynthetic intermediate of threonine, methionine and lysine.

   

L-Allothreonine

L-Allothreonine

C4H9NO3 (119.0582404)


The L-enantiomer of allothreonine. L-Allothreonine (H-allo-Thr-OH) is an endogenous metabolite.

   

2-Methyl-L-serine

alpha-Methyl-DL-serine

C4H9NO3 (119.0582404)


The L-enantiomer of 2-methylserine.

   

L-Homoserine

L-​Homoserine

C4H9NO3 (119.0582404)


The L-enantiomer of homoserine. L-Homoserine is a non - protein amino acid, which is an important biosynthetic intermediate of threonine, methionine and lysine. L-Homoserine is a non - protein amino acid, which is an important biosynthetic intermediate of threonine, methionine and lysine.

   

H-Allo-Thr-OH

L-Allo-threonine

C4H9NO3 (119.0582404)


L-Allothreonine (H-allo-Thr-OH) is an endogenous metabolite.

   
   

Allothreonine

D-Allothreonine

C4H9NO3 (119.0582404)


D-Allothreonine is the D type stereoisomer of Allothreonine. D-Allothreonine is a peptido-lipid derived from bacteria. D-Allothreonine, amide-linked to the D-galacturonic acid, is also a constituent in the polysaccharide[1][2]. L-Allothreonine (H-allo-Thr-OH) is an endogenous metabolite.

   

2-Cyanophenol

2-Hydroxybenzonitrile

C7H5NO (119.03711200000001)


CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3284; ORIGINAL_PRECURSOR_SCAN_NO 3282 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3274; ORIGINAL_PRECURSOR_SCAN_NO 3272 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3283; ORIGINAL_PRECURSOR_SCAN_NO 3280 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3277; ORIGINAL_PRECURSOR_SCAN_NO 3275 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3357; ORIGINAL_PRECURSOR_SCAN_NO 3354 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3289; ORIGINAL_PRECURSOR_SCAN_NO 3285 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7848; ORIGINAL_PRECURSOR_SCAN_NO 7844 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7866; ORIGINAL_PRECURSOR_SCAN_NO 7864 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7894; ORIGINAL_PRECURSOR_SCAN_NO 7891 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7891; ORIGINAL_PRECURSOR_SCAN_NO 7889 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7872; ORIGINAL_PRECURSOR_SCAN_NO 7870 CONFIDENCE standard compound; INTERNAL_ID 285; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7895; ORIGINAL_PRECURSOR_SCAN_NO 7890

   

Threonine; LC-tDDA; CE10

Threonine; LC-tDDA; CE10

C4H9NO3 (119.0582404)


   

Threonine; LC-tDDA; CE20

Threonine; LC-tDDA; CE20

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE10

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE10

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE20

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE20

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; AIF; CE0; CorrDec

4-Amino-3-hydroxybutyric acid; AIF; CE0; CorrDec

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; AIF; CE10; CorrDec

4-Amino-3-hydroxybutyric acid; AIF; CE10; CorrDec

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; AIF; CE30; CorrDec

4-Amino-3-hydroxybutyric acid; AIF; CE30; CorrDec

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; AIF; CE0; MS2Dec

4-Amino-3-hydroxybutyric acid; AIF; CE0; MS2Dec

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; AIF; CE10; MS2Dec

4-Amino-3-hydroxybutyric acid; AIF; CE10; MS2Dec

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; AIF; CE30; MS2Dec

4-Amino-3-hydroxybutyric acid; AIF; CE30; MS2Dec

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE30

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE30

C4H9NO3 (119.0582404)


   

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE40

4-Amino-3-hydroxybutyric acid; LC-tDDA; CE40

C4H9NO3 (119.0582404)


   

MEG (sulfate)

(2-mercaptoethyl)-guanidine sulfate

C3H9N3S (119.0517154)


   

NSC 22877

2-aminoethyl carbamimidothioate, dihydrobromide

C3H9N3S (119.0517154)


   
   

2-(2-aminoethyl)propane-1,3-diol

2-(2-aminoethyl)propane-1,3-diol

C5H13NO2 (119.0946238)


   

4-methylpyrimidine-2-carbonitrile

4-methylpyrimidine-2-carbonitrile

C6H5N3 (119.04834500000001)


   

7H-Pyrrolo[2,3-d]pyrimidine

7H-Pyrrolo[2,3-d]pyrimidine

C6H5N3 (119.04834500000001)


   

1-Amino-3-Cyclopentene Hydrochloride

1-Amino-3-Cyclopentene Hydrochloride

C5H10ClN (119.050173)


   

O-Methylserine

2-Amino-3-methoxypropanoic acid

C4H9NO3 (119.0582404)


A serine derivative that is L-serine with a methyl group replacing the hydrogen on the hydroxy side chain.

   

endo-Bicyclo[2.2.1]hept-5-ene-2-carbonitrile

endo-Bicyclo[2.2.1]hept-5-ene-2-carbonitrile

C8H9N (119.0734954)


   

Imidazo[1,2-b]pyridazine

Imidazo[1,2-b]pyridazine, methanone deriv

C6H5N3 (119.04834500000001)


   
   

2-(1-CHLORO-ETHYL)-FURAN

2-(1-CHLORO-ETHYL)-FURAN

C5H10ClN (119.050173)


   

2-Pyrimidinamine, 5-ethynyl- (9CI)

2-Pyrimidinamine, 5-ethynyl- (9CI)

C6H5N3 (119.04834500000001)


   

2(1H)-Pyridinone,3-ethynyl-(9CI)

2(1H)-Pyridinone,3-ethynyl-(9CI)

C7H5NO (119.03711200000001)


   

2-Chloropiperidine

2-Chloropiperidine

C5H10ClN (119.050173)


   

Hydrazinecarbothioamide, N,N-dimethyl-

Hydrazinecarbothioamide, N,N-dimethyl-

C3H9N3S (119.0517154)


   
   

Hydrazinecarbothioamide,N,1-dimethyl-

Hydrazinecarbothioamide,N,1-dimethyl-

C3H9N3S (119.0517154)


   

2-Amino-1,3-dimethoxypropane

2-Amino-1,3-dimethoxypropane

C5H13NO2 (119.0946238)


   

z-4-amino-3-hydroxybutyric acid

z-4-amino-3-hydroxybutyric acid

C4H9NO3 (119.0582404)


   
   

Benzenamine, 2-ethenyl-

Benzenamine, 2-ethenyl-

C8H9N (119.0734954)


   
   
   

Ethyl (4,4,4-2H3)butanoate

Ethyl (4,4,4-2H3)butanoate

C6H9D3O2 (119.102556734)


   
   

2-hydroxy-4-amino butylic acid

2-hydroxy-4-amino butylic acid

C4H9NO3 (119.0582404)


   
   

(2-PYRIDIN-2-YL-THIAZOL-4-YL)-ACETIC ACID

(2-PYRIDIN-2-YL-THIAZOL-4-YL)-ACETIC ACID

C5H13NO2 (119.0946238)


   

1-(2H3)Methyl-1,2-dihydro-5H-tetrazole-5-thione

1-(2H3)Methyl-1,2-dihydro-5H-tetrazole-5-thione

C2HD3N4S (119.034497934)


   

DL-γ-Amino-β-hydroxybutyric acid

DL-γ-Amino-β-hydroxybutyric acid

C4H9NO3 (119.0582404)


   

2-(PYRIMIDIN-4-YL)ACETONITRILE

2-(PYRIMIDIN-4-YL)ACETONITRILE

C6H5N3 (119.04834500000001)


   
   

1,1,2,2,2-pentadeuterio-N-(1,1,2,2,2-pentadeuterioethyl)ethanamine,hydrochloride

1,1,2,2,2-pentadeuterio-N-(1,1,2,2,2-pentadeuterioethyl)ethanamine,hydrochloride

C4H2ClD10N (119.12859398)


   

isobutyl nitrate

isobutyl nitrate

C4H9NO3 (119.0582404)


   
   

AMMONIUM, TETRAMETHYL-, FORMATE

AMMONIUM, TETRAMETHYL-, FORMATE

C5H13NO2 (119.0946238)


   

1H-PYRROLO[3,2-D]PYRIDAZINE

1H-PYRROLO[3,2-D]PYRIDAZINE

C6H5N3 (119.04834500000001)


   

(S)-(+)-4-Amino-3-hydroxybutyric acid

(S)-(+)-4-Amino-3-hydroxybutyric acid

C4H9NO3 (119.0582404)


   

2-vinyl-4-picoline

2-vinyl-4-picoline

C8H9N (119.0734954)


   

2-Methyl-6-vinylpyridine

2-Methyl-6-vinylpyridine

C8H9N (119.0734954)


   

N-butyl nitrate

N-butyl nitrate

C4H9NO3 (119.0582404)


   

Hydrazinecarboximidamide,N-nitro-

Hydrazinecarboximidamide,N-nitro-

CH5N5O2 (119.044323)


   

2,2-Dimethoxy-N-methylethanamine

2,2-Dimethoxy-N-methylethanamine

C5H13NO2 (119.0946238)


   

4-aminostyrene

4-aminostyrene

C8H9N (119.0734954)


   
   
   
   

2-vinyl-5-picoline

2-vinyl-5-picoline

C8H9N (119.0734954)


   

2-Methyl-2-nitropropan-1-ol

2-Methyl-2-nitropropan-1-ol

C4H9NO3 (119.0582404)


   
   

3-Nitro-2-butanol

2-Butanol, 3-nitro-

C4H9NO3 (119.0582404)


   
   

2-Propanol,1-[(2-hydroxyethyl)amino]-

2-Propanol,1-[(2-hydroxyethyl)amino]-

C5H13NO2 (119.0946238)


   
   

6-Methylpyridazine-3-carbonitrile

6-Methylpyridazine-3-carbonitrile

C6H5N3 (119.04834500000001)


   
   
   
   

4,5-dihydro-1H-pyrazolo[4,3-b]pyridine

4,5-dihydro-1H-pyrazolo[4,3-b]pyridine

C6H5N3 (119.04834500000001)


   
   
   
   

5-Methyl-2-pyrazinecarbonitrile

5-Methyl-2-pyrazinecarbonitrile

C6H5N3 (119.04834500000001)


   

3-methylpyrazine-2-carbonitrile

3-methylpyrazine-2-carbonitrile

C6H5N3 (119.04834500000001)


   

6-methylpyrazine-2-carbonitrile

6-methylpyrazine-2-carbonitrile

C6H5N3 (119.04834500000001)


   

l-serine methyl ester

l-serine methyl ester

C4H9NO3 (119.0582404)


   

2-Amino-2-ethyl-1,3-propanediol

2-Amino-2-ethyl-1,3-propanediol

C5H13NO2 (119.0946238)


   

2-Methyl-5-vinylpyridine

2-Methyl-5-vinylpyridine

C8H9N (119.0734954)


   

4-(METHYLTHIO)-1-BUTYLAMINE

4-(METHYLTHIO)-1-BUTYLAMINE

C5H13NS (119.0768658)


   
   

5-Pyrimidinecarbonitrile, 2-methyl- (7CI,8CI,9CI)

5-Pyrimidinecarbonitrile, 2-methyl- (7CI,8CI,9CI)

C6H5N3 (119.04834500000001)


   
   

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

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

C6H5N3 (119.04834500000001)


   
   

2-(PYRAZIN-2-YL)ACETONITRILE

2-(PYRAZIN-2-YL)ACETONITRILE

C6H5N3 (119.04834500000001)


   
   
   
   

Trimethylammonium acetate

Trimethylammonium acetate

C5H13NO2 (119.0946238)


   

exo-Bicyclo[2.2.1]hept-5-ene-2-carbonitrile

exo-Bicyclo[2.2.1]hept-5-ene-2-carbonitrile

C8H9N (119.0734954)


   

4-Amino-2-hydroxybutanoic acid

(2S)-4-Amino-2-hydroxybutanoic acid

C4H9NO3 (119.0582404)


   

2,2-dideuterio-2-phenylacetonitrile

2,2-dideuterio-2-phenylacetonitrile

C8H5D2N (119.070400556)


   

CYCLOPENTA[C]PYRROL-4(1H)-ONE

CYCLOPENTA[C]PYRROL-4(1H)-ONE

C7H5NO (119.03711200000001)


   

PYRROLIDINE-2-CARBALDEHYDE

PYRROLIDINE-2-CARBALDEHYDE

C5H10ClN (119.050173)


   

2-aminoethanol,2-methyloxirane

2-aminoethanol,2-methyloxirane

C5H13NO2 (119.0946238)


   

7H-Pyrrolo[2,3-c]pyridazine

7H-Pyrrolo[2,3-c]pyridazine

C6H5N3 (119.04834500000001)


   
   

5H-Pyrrolo[3,2-c]pyridazine

5H-Pyrrolo[3,2-c]pyridazine

C6H5N3 (119.04834500000001)


   

3-((2-Hydroxyethyl)amino)propanol

3-((2-Hydroxyethyl)amino)propanol

C5H13NO2 (119.0946238)


   

Benzenamine,N-ethylidene-

Benzenamine,N-ethylidene-

C8H9N (119.0734954)


   

DL-Serine hydrazide

DL-Serine hydrazide

C3H9N3O2 (119.0694734)


   

(R)-3-Amino-2-(hydroxymethyl)propanoic-acid

(R)-3-Amino-2-(hydroxymethyl)propanoic-acid

C4H9NO3 (119.0582404)


   
   

5-methyl-2-vinylpyridine

5-methyl-2-vinylpyridine

C8H9N (119.0734954)


   

Cyclopentanamine, 2-chloro-

Cyclopentanamine, 2-chloro-

C5H10ClN (119.050173)


   
   
   
   

6,7-dihydro-5H-2-pyrindine

6,7-dihydro-5H-2-pyrindine

C8H9N (119.0734954)


   

3-METHYL-5-VINYLPYRIDINE

3-METHYL-5-VINYLPYRIDINE

C8H9N (119.0734954)


   

3-AMINOSTYRENE

3-AMINOSTYRENE

C8H9N (119.0734954)


   

3-Azabicyclo[3.1.0]hexane hydrochloride (1:1)

3-Azabicyclo[3.1.0]hexane hydrochloride (1:1)

C5H10ClN (119.050173)


   
   

2-methylpyrimidine-4-carbonitrile

2-methylpyrimidine-4-carbonitrile

C6H5N3 (119.04834500000001)


   

4-Cyclopropylpyridine

4-Cyclopropylpyridine

C8H9N (119.0734954)


   
   

N-Carbamimidoyl(2,2-2H2)glycine

N-Carbamimidoyl(2,2-2H2)glycine

C3H5D2N3O2 (119.066378556)


   

(S)-2-(CHLOROMETHYL)PYRROLIDINE

(S)-2-(CHLOROMETHYL)PYRROLIDINE

C5H10ClN (119.050173)


   
   

n-benzylidenemethylamine

n-benzylidenemethylamine

C8H9N (119.0734954)


   

Guanidine acetate

Guanidine acetate

C3H9N3O2 (119.0694734)


   

5-Norbornene-2-carbonitrile

5-Norbornene-2-carbonitrile

C8H9N (119.0734954)


   

Pyridine,1,2,3,6-tetrahydro-, hydrochloride (1:1)

Pyridine,1,2,3,6-tetrahydro-, hydrochloride (1:1)

C5H10ClN (119.050173)


   

N-Methyl-L-serine

N-Methyl-L-serine

C4H9NO3 (119.0582404)


   

Hydrazinecarbothioamide,N-ethyl-

Hydrazinecarbothioamide,N-ethyl-

C3H9N3S (119.0517154)


   
   
   

4-Pyrimidinecarbonitrile, 5-methyl- (9CI)

4-Pyrimidinecarbonitrile, 5-methyl- (9CI)

C6H5N3 (119.04834500000001)


   

3-(Dimethylamino)-1-propanethiol

3-(Dimethylamino)-1-propanethiol

C5H13NS (119.0768658)


   

4-Chloropiperidine

4-Chloropiperidine

C5H10ClN (119.050173)


   

1-Butanol, 2-nitro-

1-Butanol, 2-nitro-

C4H9NO3 (119.0582404)


   

3-(chloromethyl)pyrrolidine

3-(chloromethyl)pyrrolidine

C5H10ClN (119.050173)


   

6,7-Dihydro-5H-cyclopenta[b]pyridine

6,7-Dihydro-5H-cyclopenta[b]pyridine

C8H9N (119.0734954)


   

(S)-4-Amino-2-hydroxybutanoic acid

(S)-4-Amino-2-hydroxybutanoic acid

C4H9NO3 (119.0582404)


   
   
   

[1,2,3]Triazolo[1,5-a]pyridine

[1,2,3]Triazolo[1,5-a]pyridine

C6H5N3 (119.04834500000001)


   

diethyldimethylammonium hydroxide

diethyldimethylammonium hydroxide

C6H17NO (119.1310072)


   
   

Kinase(Phosphorylating), Protein Serine or Threonine

Kinase(Phosphorylating), Protein Serine or Threonine

C4H9NO3 (119.0582404)


   

BENZYL (3-BROMO-2-OXOPROPYL)CARBAMATE

BENZYL (3-BROMO-2-OXOPROPYL)CARBAMATE

C5H13NO2 (119.0946238)


   

N-(2-Hydroxyethyl)glycine

N-(2-Hydroxyethyl)glycine

C4H9NO3 (119.0582404)


   
   
   

2-(hydroxymethylamino)-2-methylpropan-1-ol

2-(hydroxymethylamino)-2-methylpropan-1-ol

C5H13NO2 (119.0946238)


   

N-Methyldiethanolamine

N-Methyldiethanolamine

C5H13NO2 (119.0946238)


   

(S)-3-(P-BENZYLOXYPHENYL)-BETA-ALANINE

(S)-3-(P-BENZYLOXYPHENYL)-BETA-ALANINE

C4H9NO3 (119.0582404)


   

2,2-Dimethoxyacetamide

2,2-Dimethoxyacetamide

C4H9NO3 (119.0582404)


   
   

Bicyclo[1.1.1]Pentan-1-Amine Hydrochloride

Bicyclo[1.1.1]Pentan-1-Amine Hydrochloride

C5H10ClN (119.050173)


   

Ammonium isovalerate

ammonium isovalerate 30\\% in pg

C5H13NO2 (119.0946238)


It is used in butter, nut and cheese flavouring. Ammonium isovalerate is found in milk and milk products and nuts.

   
   

ammonium valerate

ammonium valerate

C5H13NO2 (119.0946238)


   

Acetamide,2-(2-hydroxyethoxy)-

Acetamide,2-(2-hydroxyethoxy)-

C4H9NO3 (119.0582404)


   

[amino(propan-2-ylsulfanyl)methylidene]azanium

[amino(propan-2-ylsulfanyl)methylidene]azanium

C4H11N2S+ (119.06429059999999)


   

6-Bromoquinazolin-2-amine

6-Bromoquinazolin-2-amine

C8H9N (119.0734954)


   

1,2,3-Propanetricarbonitrile

1,2,3-Propanetricarbonitrile

C6H5N3 (119.04834500000001)


   
   

4-Methyl-2-vinylpyridine

4-Methyl-2-vinylpyridine

C8H9N (119.0734954)


   

5-methylpyrimidine-2-carbonitrile

5-methylpyrimidine-2-carbonitrile

C6H5N3 (119.04834500000001)


   

(S)-3-amino-2-(hydroxymethyl)propanoic acid

(S)-3-amino-2-(hydroxymethyl)propanoic acid

C4H9NO3 (119.0582404)


   

(2S,3R)-2-azaniumyl-3-hydroxybutanoate

(2S,3R)-2-azaniumyl-3-hydroxybutanoate

C4H9NO3 (119.0582404)


   

2-Azaniumyl-3-hydroxybutanoate

2-Azaniumyl-3-hydroxybutanoate

C4H9NO3 (119.0582404)


   

2-Phenylethanimine

2-Phenylethanimine

C8H9N (119.0734954)


   
   

3-Hydroxy-2-(methylamino)propanoic acid

3-Hydroxy-2-(methylamino)propanoic acid

C4H9NO3 (119.0582404)


   

D-Allothreonine

D-Allothreonine

C4H9NO3 (119.0582404)


The D-enantiomer of allothreonine. It occurs as a component of peptido-lipids in certain bacteria. D-Allothreonine is the D type stereoisomer of Allothreonine. D-Allothreonine is a peptido-lipid derived from bacteria. D-Allothreonine, amide-linked to the D-galacturonic acid, is also a constituent in the polysaccharide[1][2].

   

(2S,3R)-1-Amino-2-methylbutane-2,3-diol

(2S,3R)-1-Amino-2-methylbutane-2,3-diol

C5H13NO2 (119.0946238)


   

U-6233

InChI=1\C6H5N3\c1-2-4-6-5(3-1)7-9-8-6\h1-4H,(H,7,8,9

C6H5N3 (119.04834500000001)


   

Phenylisocyanate

O2-4alpha-cyclic-tetrahydrobiopterin

C7H5NO (119.03711200000001)


O2-4a-cyclic-tetrahydrobiopterin is a novel pterin intermediate, in addition to the expected 4a-hydroxytetrahydrobiopterin (4a-OH-BH4) and quinonoid dihydrobiopterin generated during catalytic turnover of tyrosine hydroxylase (TH) with tetrahydrobiopterin as the cofactor. Its conversion into quinonoid dihydrobiopterin is catalysed by pterin-4a-carbinolamine dehydratase [HMDB]

   

(2S,3S)-2-ammonio-3-hydroxybutanoate

(2S,3S)-2-ammonio-3-hydroxybutanoate

C4H9NO3 (119.0582404)


   

(2S)-2-azaniumyl-4-hydroxybutanoate

(2S)-2-azaniumyl-4-hydroxybutanoate

C4H9NO3 (119.0582404)


   

D-Homoserine

D-Homoserine

C4H9NO3 (119.0582404)


The D-enantiomer of homoserine.

   

4-Azaniumyl-3-hydroxybutanoate

4-Azaniumyl-3-hydroxybutanoate

C4H9NO3 (119.0582404)


   

(S)-(+)-2-amino-3-hydroxy-2-methylpropionate

(S)-(+)-2-amino-3-hydroxy-2-methylpropionate

C4H9NO3 (119.0582404)


   

L-2,4-Diaminobutyrate

L-2,4-Diaminobutyrate

C4H11N2O2+ (119.0820486)


   

(2R,3S)-2-amino-3-hydroxybutanoate

(2R,3S)-2-amino-3-hydroxybutanoate

C4H9NO3 (119.0582404)


   

(2R)-2-azaniumyl-4-hydroxybutanoate

(2R)-2-azaniumyl-4-hydroxybutanoate

C4H9NO3 (119.0582404)


   

2-Ammonio-3-hydroxy-2-methylpropanoate

2-Ammonio-3-hydroxy-2-methylpropanoate

C4H9NO3 (119.0582404)


   

(2R,3R)-2-azaniumyl-3-hydroxybutanoate

(2R,3R)-2-azaniumyl-3-hydroxybutanoate

C4H9NO3 (119.0582404)


   

2-Hydroxy-4-aminobutanoate

2-Hydroxy-4-aminobutanoate

C4H9NO3 (119.0582404)


   

3-Methoxyalanine

3-Methoxyalanine

C4H9NO3 (119.0582404)


   

3,4-Dihydroxybutanoate

3,4-Dihydroxybutanoate

C4H7O4- (119.0344322)


   

[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]azanium

[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]azanium

C4H11N2O2+ (119.0820486)


   

Formiminoglycine methyl ester

Formiminoglycine methyl ester

C4H11N2O2+ (119.0820486)


   

2-Amino-2-hydroxybutanoic acid

2-Amino-2-hydroxybutanoic acid

C4H9NO3 (119.0582404)


An alpha-amino acid that is butanoic acid substituted by an amino and a hydroxy group at position 2.

   

(3E)-3-(methoxyimino)propane-1,2-diol

(3E)-3-(methoxyimino)propane-1,2-diol

C4H9NO3 (119.0582404)


   

Ethanaminium propionate

Ethanaminium propionate

C5H13NO2 (119.0946238)


   

2,3-Dihydroxy-2-methylpropanoate

2,3-Dihydroxy-2-methylpropanoate

C4H7O4- (119.0344322)


   

4-Iminobutane-1,2,3-triol

4-Iminobutane-1,2,3-triol

C4H9NO3 (119.0582404)


   

3-Methylthiopropanaldoxime

3-Methylthiopropanaldoxime

C4H9NOS (119.0404824)


   

(-)-(2R,3R)-2,3-dihydroxybutanamide

(-)-(2R,3R)-2,3-dihydroxybutanamide

C4H9NO3 (119.0582404)


   

Methoxy-trimethylsilylamine

Methoxy-trimethylsilylamine

C4H13NOSi (119.0766368)


   

D-Threonine

D-(+)-Threonine

C4H9NO3 (119.0582404)


An optically active form of threonine having D-configuration. DL-Threonine, an essential amino acid, has the potential to treat hypostatic leg ulceration[1].

   

4-Amino-3-hydroxybutyric acid

DL-γ-Amino-β-hydroxybutyric acid

C4H9NO3 (119.0582404)


   

N-Acetylcysteamine

Acetamide,N-(2-mercaptoethyl)-

C4H9NOS (119.0404824)


A member of the class of acetamides that is the N-acetyl-deriavtive of cysteamine.

   

L-allothreonine zwitterion

L-allothreonine zwitterion

C4H9NO3 (119.0582404)


Zwitterionic form of L-allothreonine.

   

L-threonine zwitterion

L-threonine zwitterion

C4H9NO3 (119.0582404)


Zwitterionic form of L-threonine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3.

   

2-methyl-L-serine zwitterion

2-methyl-L-serine zwitterion

C4H9NO3 (119.0582404)


An amino acid zwitterion obtained from the transfer of a proton from the carboxy group to the amino group of 2-methyl-L-serine. Major species at pH 7.3.

   

D-threonine zwitterion

D-threonine zwitterion

C4H9NO3 (119.0582404)


A D-alpha-amino acid zwitterion that is D-threonine in which a proton has been transferred from the carboxy group to the amino group. It is the major species at pH 7.3.

   
   

N,N-Dimethylformamide dimethyl acetal

N,N-Dimethylformamide dimethyl acetal

C5H13NO2 (119.0946238)


   
   

imidazopyridine

1H-imidazo[4,5-b]pyridine

C6H5N3 (119.04834500000001)


   

2-(2-Aminoethoxy)acetic acid

2-(2-Aminoethoxy)acetic acid

C4H9NO3 (119.0582404)


   

2-hydroxyethyl 2-aminoacetate

2-hydroxyethyl 2-aminoacetate

C4H9NO3 (119.0582404)


   

DBA

(-)-erythro-(2R,3R)-Dihydroxybutylamide

C4H9NO3 (119.0582404)


   

D-allothreonine zwitterion

D-allothreonine zwitterion

C4H9NO3 (119.0582404)


A D-alpha-amino acid zwitterion that is D-allothreonine in which a proton has been transferred from the carboxy group to the amino group. It is the major species at pH 7.3.

   

D-homoserine zwitterion

D-homoserine zwitterion

C4H9NO3 (119.0582404)


A D-alpha-amino acid zwitterion arising from transfer of a proton from the carboxy to the amino group of D-homoserine; major species at pH 7.3.

   

gamma-Amino-beta-hydroxybutyric acid

gamma-Amino-beta-hydroxybutyric acid

C4H9NO3 (119.0582404)


A gamma-amino acid comprising 4-aminobutyric acid having a 2-hydroxy substituent.

   

L-homoserine zwitterion

L-homoserine zwitterion

C4H9NO3 (119.0582404)


Zwitterionic form of L-homoserine.

   

L-2,4-diazaniumylbutyrate

L-2,4-diazaniumylbutyrate

C4H11N2O2 (119.0820486)


Conjugate acid of L-2,4-diaminobutyric acid.

   

Alpha-Methylserine

Alpha-Methylserine

C4H9NO3 (119.0582404)


   
   

O-Methyl-serine

O-Methyl-serine

C4H9NO3 (119.0582404)


   

Threonine/Homoserine

Threonine/Homoserine

C4H9NO3 (119.0582404)


   

n-(2-sulfanylethyl)ethanimidic acid

n-(2-sulfanylethyl)ethanimidic acid

C4H9NOS (119.0404824)


   

3-(methylsulfanyl)propanimidic acid

3-(methylsulfanyl)propanimidic acid

C4H9NOS (119.0404824)


   

4-(prop-1-en-2-yl)pyridine

4-(prop-1-en-2-yl)pyridine

C8H9N (119.0734954)