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CHEBI:73314 - Ala-Ala-Asp-Asp

ChEBI IDCHEBI:73314
ChEBI NameAla-Ala-Asp-Asp
Stars
DefinitionA tetrapeptide composed of two L-alanine units linked to two L-aspartic acid units by peptide linkages.
Last Modified17 May 2013
Submittermwilliams
DownloadsMolfile
FormulaC14H22N4O9
Net Charge0
Average Mass390.349
Monoisotopic Mass390.13868
SMILESC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C14H22N4O9/c1-5(15)11(23)16-6(2)12(24)17-7(3-9(19)20)13(25)18-8(14(26)27)4-10(21)22/h5-8H,3-4,15H2,1-2H3,(H,16,23)(H,17,24)(H,18,25)(H,19,20)(H,21,22)(H,26,27)/t5-,6-,7-,8-/m0/s1
InChIKeyYHOPXCAOTRUGLV-XAMCCFCMSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Ala-Ala-Asp-Asp (CHEBI:73314) has functional parent L-alanine (CHEBI:16977)
Ala-Ala-Asp-Asp (CHEBI:73314) has functional parent L-aspartic acid (CHEBI:17053)
Ala-Ala-Asp-Asp (CHEBI:73314) has role metabolite (CHEBI:25212)
Ala-Ala-Asp-Asp (CHEBI:73314) is a tetrapeptide (CHEBI:48030)
IUPAC Name 
L-alanyl-L-alanyl-L-α-aspartyl-L-aspartic acid
Synonyms  Source
AADDChEBI
A-A-D-DChEBI
L-Ala-L-Ala-L-Asp-L-AspChEBI
Registry NumbersSources
Reaxys:4890080Reaxys