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 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H12N2O3 Net Charge 0 Average Mass 160.17116 Monoisotopic Mass 160.08479 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:txid562) See: PubMed Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) 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 Manual Xrefs Databases C00019576 KNApSAcK C00993 KEGG COMPOUND HMDB0003459 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 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