Exact Mass: 217.1063

Exact Mass Matches: 217.1063

Found 49 metabolites which its exact mass value is equals to given mass value 217.1063, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

N-acetylcitrulline

(2S)-2-(Acetylamino)-5-[(aminocarbonyl)amino]pentanoic acid

C8H15N3O4 (217.1063)


N-alpha-Acetyl-L-citrulline, also known as N-acetylcitrulline, is an N-acetylated metabolite of citrulline that is part of the arginine biosynthetic pathway. Arginine biosynthesis is notable for its complexity and variability at the genetic level, and by its connection with several other pathways, such as pyrimidine and polyamine biosynthesis, and certain degradative pathways. The initial steps of the arginine biosynthetic pathways proceed via N-acetylated intermediates. The presumed reason for this is that the acetylation prevents the spontaneous cyclization of glutamate derivatives, which leads to proline biosynthesis. N-acetyl-L-ornithine can be transcarbamylated directly by the enzyme acetylornithine transcarbamylase, resulting in N-acetyl-L-citrulline. The enzyme acetylornithine deacetylase can accept N-acetyl-L-citrulline as a substrate and can deacetylate it into citrulline. N-alpha-Acetyl-L-citrulline is found in cases of deficiency of the urea cycle enzyme argininosuccinate synthase (EC 6.3.4.5) that leads to increased concentrations of citrulline and N-acetylcitrulline in the urine (PMID: 14633929). N-acetyl-l-citrulline, also known as (S)-2-acetamido-5-ureidopentanoic acid, is a member of the class of compounds known as N-acyl-l-alpha-amino acids. N-acyl-l-alpha-amino acids are n-acylated alpha amino acids which have the L-configuration of the alpha-carbon atom. N-acetyl-l-citrulline is slightly soluble (in water) and a weakly acidic compound (based on its pKa). N-acetyl-l-citrulline can be found in a number of food items such as macadamia nut, persian lime, broccoli, and annual wild rice, which makes N-acetyl-l-citrulline a potential biomarker for the consumption of these food products.

   

N-Acetyl-L-citrulline

N-Acetyl-L-citrulline

C8H15N3O4 (217.1063)


   

Glutaminylalanine

(2S)-2-{[(2S)-2-amino-1-hydroxy-4-(C-hydroxycarbonimidoyl)butylidene]amino}propanoate

C8H15N3O4 (217.1063)


Glutaminylalanine is a dipeptide composed of glutamine and alanine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

   

Alanylglutamine

(2S)-2-{[(2S)-2-amino-1-hydroxypropylidene]amino}-4-(C-hydroxycarbonimidoyl)butanoate

C8H15N3O4 (217.1063)


Alanylglutamine is a dipeptide composed of alanine and glutamine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. B - Blood and blood forming organs > B05 - Blood substitutes and perfusion solutions > B05X - I.v. solution additives > B05XB - Amino acids L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1]. L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1].

   

Alanyl-Gamma-glutamate

2-Amino-4-[(2-aminopropanoyl)-C-hydroxycarbonimidoyl]butanoate

C8H15N3O4 (217.1063)


Alanyl-Gamma-glutamate is a dipeptide composed of alanine and gamma-glutamate. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

2-(2-Aminopropanylamino)-4-carbamoylbutyric acid

2-[(2-Amino-1-hydroxypropylidene)amino]-4-(C-hydroxycarbonimidoyl)butanoate

C8H15N3O4 (217.1063)


   

H-Ala-Ala-Gly-OH

H-Ala-Ala-Gly-OH

C8H15N3O4 (217.1063)


   

Acetylcitrulline

Acetylcitrulline

C8H15N3O4 (217.1063)


MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; WMQMIOYQXNRROC-LURJTMIESA-N_STSL_0245_Acetylcitrulline_1000fmol_190413_S2_LC02MS02_076; 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.

   

Na-Acetylcitrulline; LC-tDDA; CE10

Na-Acetylcitrulline; LC-tDDA; CE10

C8H15N3O4 (217.1063)


   

Na-Acetylcitrulline; LC-tDDA; CE20

Na-Acetylcitrulline; LC-tDDA; CE20

C8H15N3O4 (217.1063)


   

Na-Acetylcitrulline; LC-tDDA; CE30

Na-Acetylcitrulline; LC-tDDA; CE30

C8H15N3O4 (217.1063)


   

Na-Acetylcitrulline; LC-tDDA; CE40

Na-Acetylcitrulline; LC-tDDA; CE40

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; AIF; CE0; CorrDec

Alanyl-Glutamine; AIF; CE0; CorrDec

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; AIF; CE10; CorrDec

Alanyl-Glutamine; AIF; CE10; CorrDec

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; AIF; CE30; CorrDec

Alanyl-Glutamine; AIF; CE30; CorrDec

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; AIF; CE0; MS2Dec

Alanyl-Glutamine; AIF; CE0; MS2Dec

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; AIF; CE10; MS2Dec

Alanyl-Glutamine; AIF; CE10; MS2Dec

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; AIF; CE30; MS2Dec

Alanyl-Glutamine; AIF; CE30; MS2Dec

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; LC-tDDA; CE10

Alanyl-Glutamine; LC-tDDA; CE10

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; LC-tDDA; CE20

Alanyl-Glutamine; LC-tDDA; CE20

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; LC-tDDA; CE30

Alanyl-Glutamine; LC-tDDA; CE30

C8H15N3O4 (217.1063)


   

Alanyl-Glutamine; LC-tDDA; CE40

Alanyl-Glutamine; LC-tDDA; CE40

C8H15N3O4 (217.1063)


   
   
   
   
   
   

Ala-GLN

2-(2-amino-4-carbamoylbutanamido)propanoic acid

C8H15N3O4 (217.1063)


A dipeptide formed from L-alanyl and L-glutamine residues.

   

Ala-gglu

2-[2-amino-4-(C-hydroxycarbonimidoyl)butanamido]propanoic acid

C8H15N3O4 (217.1063)


   

GLN-Ala

2-(2-aminopropanamido)-4-carbamoylbutanoic acid

C8H15N3O4 (217.1063)


   

GGlu-Ala

2-(2-aminopropanamido)-4-(C-hydroxycarbonimidoyl)butanoic acid

C8H15N3O4 (217.1063)


   

4-[Chloro(diisopropyl)silyl]butanenitrile

4-[Chloro(diisopropyl)silyl]butanenitrile

C10H20ClNSi (217.1053)


   

H-D-Ala-Gln-OH

H-D-Ala-Gln-OH

C8H15N3O4 (217.1063)


   

H-Ala-gly-ala-OH

H-Ala-gly-ala-OH

C8H15N3O4 (217.1063)


   

H-Gly-Ala-Ala-OH

H-Gly-Ala-Ala-OH

C8H15N3O4 (217.1063)


   

N-alpha-Acetylcitrulline

N-alpha-Acetylcitrulline

C8H15N3O4 (217.1063)


N-a-Acetylcitrulline is an N-acetylated metabolite of citrulline that is part of the arginine biosynthetic pathway. Arginine biosynthesis is notable for its complexity and variability at the genetic level, and by its connection with several other pathways, such as pyrimidine and polyamine biosynthesis, and certain degradative pathways. The initial steps of the arginine biosynthetic pathways proceed via N-acetylated intermediates. The presumed reason for this is that the acetylation prevents the spontaneous cyclization of glutamate derivatives, which leads to proline biosynthesis. N-acetyl-L-ornithine can be transcarbamylated directly by the enzyme acetylornithine transcarbamylase, resulting in N-acetyl-L-citrulline. The enzyme acetylornithine deacetylase can accept N-acetyl-L-citrulline as a substrate, and can deacetylate it into citrulline. N-a-Acetylcitrulline is found in cases of deficiency of the urea cycle enzyme argininosuccinate synthase (EC 6.3.4.5) that leads to increased concentrations of citrulline and N-acetylcitrulline in the urine. (PMID: 14633929) [HMDB]

   

(2S)-5-amino-2-{[(2S)-2-azaniumylpropanoyl]amino}-5-oxopentanoate

(2S)-5-amino-2-{[(2S)-2-azaniumylpropanoyl]amino}-5-oxopentanoate

C8H15N3O4 (217.1063)


   
   

H-Ala-D-Glu-NH2

H-Ala-D-Glu-NH2

C8H15N3O4 (217.1063)


   

H-Ala-Gln-OH

L-Alanyl-L-glutamine

C8H15N3O4 (217.1063)


B - Blood and blood forming organs > B05 - Blood substitutes and perfusion solutions > B05X - I.v. solution additives > B05XB - Amino acids L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1]. L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1].

   

Ala-Gln zwitterion

Ala-Gln zwitterion

C8H15N3O4 (217.1063)


A peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Ala-Gln.

   

Glutaminylalanine

Glutaminylalanine

C8H15N3O4 (217.1063)


   

Alanyl-Gamma-glutamate

Alanyl-Gamma-glutamate

C8H15N3O4 (217.1063)


   

N-acetylcitrulline

N-acetylcitrulline

C8H15N3O4 (217.1063)


   

Ala-Ala-Gly

Ala-Ala-Gly

C8H15N3O4 (217.1063)


A tripeptide composed of two L-alanine units and a glycine joined by peptide linkages.

   
   
   

(2s)-2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-4-(c-hydroxycarbonimidoyl)butanoic acid

(2s)-2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-4-(c-hydroxycarbonimidoyl)butanoic acid

C8H15N3O4 (217.1063)


   

{[(2s)-2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-1-hydroxypropylidene]amino}acetic acid

{[(2s)-2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-1-hydroxypropylidene]amino}acetic acid

C8H15N3O4 (217.1063)