Chemical Formula: C6H12N2O3

Chemical Formula C6H12N2O3

Found 64 metabolite its formula value is C6H12N2O3

D-Alanyl-D-alanine

(2R)-2-[(2R)-2-aminopropanamido]propanoic acid

C6H12N2O3 (160.0847882)


The ATP-dependent carboxylate-amine/thiol ligase superfamily is known to contain enzymes catalyzing the formation of various types of peptide, one of which is d-alanyl-d-alanine.(PMID: 16030213). The glycopeptide antibiotic vancomycin acts by binding to the D-alanyl-D-alanine terminus of the cell wall precursor lipid II in the cytoplasmic membrane.(PMID: 17418637). D-alanine-D-alanine ligase from Thermotoga maritima ATCC 43589 (TmDdl) was a useful biocatalyst for synthesizing D-amino acid dipeptides.D-Alanine-D-alanine ligase (Ddl) catalyzes the biosynthesis of an essential bacterial peptidoglycan precursor D-alanyl-D-alanine and it represents an important target for development of new antibacterial drugs. (PMID: 17267218). D-Alanyl-D-alanine is a microbial metabolite. Alanyl-alanine, also known as ala-ala or A-a dipeptide, is a member of the class of compounds known as dipeptides. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Alanyl-alanine is soluble (in water) and a weakly acidic compound (based on its pKa). Alanyl-alanine can be found in chives, which makes alanyl-alanine a potential biomarker for the consumption of this food product. Alanyl-alanine can be found primarily in feces. Alanyl-alanine exists in all living organisms, ranging from bacteria to humans. Acquisition and generation of the data is financially supported in part by CREST/JST. D-Ala-D-Ala constitutes the terminus of the peptide part of the peptidoglycan monomer unit and is involved in the transpeptidation reaction as the substrate. D-Ala-D-Ala is catalyzed by D-Alanine-D-Alanine ligase. D-Ala-D-Ala is a bacterial endogenous metabolite[1][2].

   

Daminozide

3-(N,N-dimethylhydrazinecarbonyl)propanoic acid

C6H12N2O3 (160.0847882)


D006133 - Growth Substances > D010937 - Plant Growth Regulators CONFIDENCE standard compound; INTERNAL_ID 2629 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals KEIO_ID D173 Daminozide, a plant growth regulator, is a selective inhibitor of the human KDM2/7 histone demethylases, with IC50s of 0.55, 1.5 and 2.1 μM for PHF8, KDM2A, and KIAA1718, respectively. Daminozide has >100-fold selectivity for KDM2/7 subfamily versus other demethylase subfamily members tested[1][2].

   

N5-methylglutamine

2-amino-5-(methylamino)-5-oxopentanoic acid

C6H12N2O3 (160.0847882)


   

4-Acetamido-2-aminobutanoic acid

(2S)-4-(acetylamino)-2-aminobutanoic acid

C6H12N2O3 (160.0847882)


4-Acetamido-2-aminobutanoic acid is found in sugar bee

   

SCHEMBL648868

(2S)-2-acetamido-4-aminobutanoic acid

C6H12N2O3 (160.0847882)


   

Daminozide

2,2-Dimethylhydrazid kyseliny jantarove [Czech]

C6H12N2O3 (160.0847882)


Succinic acid 2,2-dimethylhydrazide appears as odorless white crystals or powder. (NTP, 1992) Daminozide is a straight-chain fatty acid. Daminozide — also known as Alar, Kylar, B-NINE, DMASA, SADH, or B 995 — is a plant growth regulator, a chemical sprayed on fruit to regulate their growth, make their harvest easier, and keep apples from falling off the trees before they are ripe. This makes sure they are red and firm for storage. Alar was first approved for use in the U.S. in 1963, it was primarily used on apples until 1989 when it was voluntarily withdrawn by the manufacturer after the U.S. Environmental Protection Agency proposed banning it based on unacceptably high cancer risks to consumers. D006133 - Growth Substances > D010937 - Plant Growth Regulators D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals Daminozide, a plant growth regulator, is a selective inhibitor of the human KDM2/7 histone demethylases, with IC50s of 0.55, 1.5 and 2.1 μM for PHF8, KDM2A, and KIAA1718, respectively. Daminozide has >100-fold selectivity for KDM2/7 subfamily versus other demethylase subfamily members tested[1][2].

   

Alanylalanine

(2S)-2-[(2S)-2-aminopropanamido]propanoic acid

C6H12N2O3 (160.0847882)


Alanyl-alanine, also known as ala-ala or A-a dipeptide, is a member of the class of compounds known as dipeptides. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Alanyl-alanine is soluble (in water) and a weakly acidic compound (based on its pKa). Alanyl-alanine can be found in chives, which makes alanyl-alanine a potential biomarker for the consumption of this food product. Alanyl-alanine can be found primarily in feces. Alanyl-alanine exists in all living organisms, ranging from bacteria to humans. Alanylalanine is a dipeptide composed of two alanine residues. 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.

   

(S)-Methyl 2,5-diamino-5-oxopentanoate

(S)-Methyl 2,5-diamino-5-oxopentanoic acid

C6H12N2O3 (160.0847882)


   

d-Alanyl-l-alanine

2-[(2-amino-1-hydroxypropylidene)amino]propanoic acid

C6H12N2O3 (160.0847882)


The ATP-dependent carboxylate-amine/thiol ligase superfamily is known to contain enzymes catalyzing the formation of various types of peptide, one of which is d-alanyl-d-alanine.(PMID: 16030213); ; The glycopeptide antibiotic vancomycin acts by binding to the D-alanyl-D-alanine terminus of the cell wall precursor lipid II in the cytoplasmic membrane.(PMID: 17418637); ; D-alanine-D-alanine ligase from Thermotoga maritima ATCC 43589 (TmDdl) was a useful biocatalyst for synthesizing D-amino acid dipeptides.D-Alanine-D-alanine ligase (Ddl) catalyzes the biosynthesis of an essential bacterial peptidoglycan precursor D-alanyl-D-alanine and it represents an important target for development of new antibacterial drugs. (PMID: 17267218). D-Alanyl-D-alanine is found in rice. D-Ala-D-Ala constitutes the terminus of the peptide part of the peptidoglycan monomer unit and is involved in the transpeptidation reaction as the substrate. D-Ala-D-Ala is catalyzed by D-Alanine-D-Alanine ligase. D-Ala-D-Ala is a bacterial endogenous metabolite[1][2].

   

N-Nitroso(2-hydroxypropyl)(2-oxopropyl)amine

1-[(2-hydroxypropyl)(nitroso)amino]propan-2-one

C6H12N2O3 (160.0847882)


D009676 - Noxae > D002273 - Carcinogens

   

2-amino-4-(2-aminoethoxy)but-3-enoic acid

2-amino-4-(2-aminoethoxy)but-3-enoic acid

C6H12N2O3 (160.0847882)


   

L-beta-homoglutamine-HCl

L-beta-homoglutamine-HCl

C6H12N2O3 (160.0847882)


   

allophanic acid butyl ester

allophanic acid butyl ester

C6H12N2O3 (160.0847882)


   

Diamide-3-Hydroxy-3-methylpentanedioic acid

Diamide-3-Hydroxy-3-methylpentanedioic acid

C6H12N2O3 (160.0847882)


   

2,6-diamino-4-oxohexanoic acid

2,6-diamino-4-oxohexanoic acid

C6H12N2O3 (160.0847882)


   

H-Ala-Ala-OH

L-Alanyl-L-alanine

C6H12N2O3 (160.0847882)


A dipeptide consisting of two L-alanine units joined by a peptide linkage. CONFIDENCE standard compound; ML_ID 46

   

D-Ala-D-ala

H-D-Ala-D-Ala-OH

C6H12N2O3 (160.0847882)


D-Ala-D-Ala constitutes the terminus of the peptide part of the peptidoglycan monomer unit and is involved in the transpeptidation reaction as the substrate. D-Ala-D-Ala is catalyzed by D-Alanine-D-Alanine ligase. D-Ala-D-Ala is a bacterial endogenous metabolite[1][2].

   
   

Asparagine ethyl ester

Asparagine ethyl ester

C6H12N2O3 (160.0847882)


   
   
   
   

N-g-Acetyldiaminobutyric acid

4-Acetamido-2-aminobutanoic acid

C6H12N2O3 (160.0847882)


   
   

Hexanedioic acid,1-hydrazide

Hexanedioic acid,1-hydrazide

C6H12N2O3 (160.0847882)


   
   

4-Glycylaminobutyric acid

Butanoic acid,4-[(2-aminoacetyl)amino]-

C6H12N2O3 (160.0847882)


   

l-homoglutamine

2,6-Diamino-6-oxohexanoic acid

C6H12N2O3 (160.0847882)


   

L-Alanylglycine methyl ester

L-Alanylglycine methyl ester

C6H12N2O3 (160.0847882)


   

3-METHYL-2-UREIDO-BUTYRIC ACID

3-METHYL-2-UREIDO-BUTYRIC ACID

C6H12N2O3 (160.0847882)


   
   
   

dl-alanyl-l-alanine

dl-alanyl-l-alanine

C6H12N2O3 (160.0847882)


   

2(1H)-Pyrimidinone,tetrahydro-1,3-bis(hydroxymethyl)-

2(1H)-Pyrimidinone,tetrahydro-1,3-bis(hydroxymethyl)-

C6H12N2O3 (160.0847882)


   

N-carbamoyl-D-valine

N-carbamoyl-D-valine

C6H12N2O3 (160.0847882)


   
   

Methyl 2,5-diamino-5-oxopentanoate

Methyl 2,5-diamino-5-oxopentanoate

C6H12N2O3 (160.0847882)


   

N-carbamoyl-L-valine

N-carbamoyl-L-valine

C6H12N2O3 (160.0847882)


   

2-methyl-L-glutamine

2-methyl-L-glutamine

C6H12N2O3 (160.0847882)


A non-proteinogenic L-alpha-amino acid that is L-glutamine substituted by a methyl group at position 2.

   

4-Amino-2-(ethylamino)-4-oxobutanoic acid

4-Amino-2-(ethylamino)-4-oxobutanoic acid

C6H12N2O3 (160.0847882)


   

Ethyl 3-(carbamoylamino)propanoate

Ethyl 3-(carbamoylamino)propanoate

C6H12N2O3 (160.0847882)


   

(3S)-3,6-diamino-6-oxohexanoic acid

(3S)-3,6-diamino-6-oxohexanoic acid

C6H12N2O3 (160.0847882)


   
   

Ethyl 2-amino-3-carbamoylpropanoate

Ethyl 2-amino-3-carbamoylpropanoate

C6H12N2O3 (160.0847882)


   

5-Hydroxyamino-3-methyl-pyrrolidine-2-carboxylic acid

5-Hydroxyamino-3-methyl-pyrrolidine-2-carboxylic acid

C6H12N2O3 (160.0847882)


   

(2R)-2-{[(2R)-2-ammoniopropanoyl]amino}propanoate

(2R)-2-{[(2R)-2-ammoniopropanoyl]amino}propanoate

C6H12N2O3 (160.0847882)


   
   

(2S)-4-acetamido-2-ammoniobutanoate

(2S)-4-acetamido-2-ammoniobutanoate

C6H12N2O3 (160.0847882)


   

(2S)-2-amino-5-(methylamino)-5-oxopentanoate

(2S)-2-amino-5-(methylamino)-5-oxopentanoate

C6H12N2O3 (160.0847882)


   

(2S)-2-acetamido-4-ammoniobutanoate

(2S)-2-acetamido-4-ammoniobutanoate

C6H12N2O3 (160.0847882)


   

N-(2-aminobutanoyl)glycine

N-(2-aminobutanoyl)glycine

C6H12N2O3 (160.0847882)


   
   

N-ethyl-L-asparagine

N-ethyl-L-asparagine

C6H12N2O3 (160.0847882)


An optically active form of N-ethylasparagine having L-configuration.

   

D-Alanyl-D-alanine

D-Alanyl-D-alanine

C6H12N2O3 (160.0847882)


A dipeptide comprising D-alanine with a D-alanyl residue attached to the alpha-nitrogen. It is a component of bacterial peptidoglycan and forms an important target for development of antibacterial drugs . D-Ala-D-Ala constitutes the terminus of the peptide part of the peptidoglycan monomer unit and is involved in the transpeptidation reaction as the substrate. D-Ala-D-Ala is catalyzed by D-Alanine-D-Alanine ligase. D-Ala-D-Ala is a bacterial endogenous metabolite[1][2].

   

(2S)-4-(acetylamino)-2-aminobutanoic acid

(2S)-4-(acetylamino)-2-aminobutanoic acid

C6H12N2O3 (160.0847882)


   

(2S)-2-acetamido-4-aminobutanoic acid

(2S)-2-acetamido-4-aminobutanoic acid

C6H12N2O3 (160.0847882)


An N-acetyl-L-amino that is the N(2)-acetyl derivative of L-2,4-diaminobutyric acid.

   

(2S)-2-acetamido-4-aminobutanoic acid zwitterion

(2S)-2-acetamido-4-aminobutanoic acid zwitterion

C6H12N2O3 (160.0847882)


An amino acid zwitterion obtained by transfer of a proton from the amino to the carboxy group of (2S)-2-acetamido-4-aminobutanoic acid; major species at pH 7.3.

   

DL-Alanyl-DL-alanine

DL-Alanyl-DL-alanine

C6H12N2O3 (160.0847882)


   

N-ethylasparagine

N-ethylasparagine

C6H12N2O3 (160.0847882)


A dicarboxylic acid monoamide that is asparagine in which one of the hydrogens attached to the nitrogen of the alpha-amino group is replaced by an ethyl group.

   

Butanoic acid, 4-(acetylamino)-2-amino-

Butanoic acid, 4-(acetylamino)-2-amino-

C6H12N2O3 (160.0847882)


   

D-alanyl-D-alanine zwitterion

D-alanyl-D-alanine zwitterion

C6H12N2O3 (160.0847882)


A dipeptide zwitterion that is the zwitterionic form of D-alanyl-D-alanine arising from migration of a proton from the OH of the carboxy terminus to the amino terminus.

   

N(5)-methyl-L-glutamine zwitterion

N(5)-methyl-L-glutamine zwitterion

C6H12N2O3 (160.0847882)


The amino acid zwitterion arising from transfer of a proton from the carboxy to the amino group of N(5)-methyl-L-glutamine; major species at pH 7.3.

   

Ala-Ala zwitterion

Ala-Ala zwitterion

C6H12N2O3 (160.0847882)


A dipeptide zwitterion resulting from the transfer of a proton from the carboxy to the amino group of Ala-Ala; major species at pH 7.3.

   

N(5)-Methyl-glutamine

N(5)-Methyl-glutamine

C6H12N2O3 (160.0847882)