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CHEBI:16576 - D-alanyl-D-alanine

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ChEBI Name D-alanyl-D-alanine
ChEBI ID CHEBI:16576
ChEBI ASCII Name D-alanyl-D-alanine
Definition A dipeptide comprising D-alanine with a D-alanyl residue attached to the α-nitrogen. It is a component of bacterial peptidoglycan and forms an important target for development of antibacterial drugs .
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:4088, CHEBI:13749, CHEBI:20894, CHEBI:12900
Supplier Information
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Formula C6H12N2O3
Net Charge 0
Average Mass 160.17116
Monoisotopic Mass 160.085
InChI InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4-/m1/s1
InChIKey DEFJQIDDEAULHB-QWWZWVQMSA-N
SMILES C[C@@H](N)C(=O)N[C@H](C)C(O)=O
Metabolite of Species Details
Escherichia coli (NCBI:562) See: PubMed
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing D-alanyl-D-alanine (CHEBI:16576) has role Escherichia coli metabolite (CHEBI:76971)
D-alanyl-D-alanine (CHEBI:16576) is a dipeptide (CHEBI:46761)
D-alanyl-D-alanine (CHEBI:16576) is tautomer of D-alanyl-D-alanine zwitterion (CHEBI:57822)
Incoming D-alanyl-D-alanine zwitterion (CHEBI:57822) is tautomer of D-alanyl-D-alanine (CHEBI:16576)
Synonyms Sources
(D-Ala)2 ChEBI
D-Ala-D-Ala KEGG COMPOUND
D-Ala-D-Ala JCBN
D-Alanyl-D-alanine KEGG COMPOUND
H-D-Ala-D-Ala-OH ChEBI
Database Links Databases
C00019576 KNApSAcK
C00993 KEGG COMPOUND
HMDB03459 HMDB
View more database links
Registry Numbers Types Sources
1724814 Beilstein Registry Number Beilstein
1724814 Reaxys Registry Number Reaxys
923-16-0 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations Types Sources
16030213 PubMed citation Europe PMC
19053785 PubMed citation Europe PMC
24440607 PubMed citation Europe PMC
61706 PubMed citation Europe PMC
Last Modified
25 January 2016