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CHEBI:73414 - Asn-Trp-Asp-Ser

ChEBI IDCHEBI:73414
ChEBI NameAsn-Trp-Asp-Ser
Stars
DefinitionA tetrapeptide composed of L-asparagine, L-tryptophan, L-aspartic acid and L-serine joined in sequence by peptide linkages.
Last Modified20 May 2013
Submittermwilliams
DownloadsMolfile
FormulaC22H28N6O9
Net Charge0
Average Mass520.499
Monoisotopic Mass520.19178
SMILESNC(=O)C[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O
InChIInChI=1S/C22H28N6O9/c23-12(6-17(24)30)19(33)26-14(5-10-8-25-13-4-2-1-3-11(10)13)20(34)27-15(7-18(31)32)21(35)28-16(9-29)22(36)37/h1-4,8,12,14-16,25,29H,5-7,9,23H2,(H2,24,30)(H,26,33)(H,27,34)(H,28,35)(H,31,32)(H,36,37)/t12-,14-,15-,16-/m0/s1
InChIKeyWSNSZZGIMVHDHF-TUUVXOQKSA-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)
Asn-Trp-Asp-Ser (CHEBI:73414) has functional parent L-asparagine (CHEBI:17196)
Asn-Trp-Asp-Ser (CHEBI:73414) has functional parent L-aspartic acid (CHEBI:17053)
Asn-Trp-Asp-Ser (CHEBI:73414) has functional parent L-serine (CHEBI:17115)
Asn-Trp-Asp-Ser (CHEBI:73414) has functional parent L-tryptophan (CHEBI:16828)
Asn-Trp-Asp-Ser (CHEBI:73414) has role metabolite (CHEBI:25212)
Asn-Trp-Asp-Ser (CHEBI:73414) is a tetrapeptide (CHEBI:48030)
IUPAC Name 
L-asparaginyl-L-tryptophyl-L-α-aspartyl-L-serine
Synonyms  Source
NWDSChEBI
N-W-D-SChEBI
L-Asn-L-Trp-L-Asp-L-SerChEBI