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CHEBI:141425 - Asn-Trp

ChEBI IDCHEBI:141425
ChEBI NameAsn-Trp
Stars
DefinitionA dipeptide obtained by formal condensation of the carboxy group of L-asparagine with the amino group of L-tryptophan.
Last Modified10 October 2018
Submittermwilliams
DownloadsMolfile
FormulaC15H18N4O4
Net Charge0
Average Mass318.333
Monoisotopic Mass318.13281
SMILESNC(=O)C[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C15H18N4O4/c16-10(6-13(17)20)14(21)19-12(15(22)23)5-8-7-18-11-4-2-1-3-9(8)11/h1-4,7,10,12,18H,5-6,16H2,(H2,17,20)(H,19,21)(H,22,23)/t10-,12-/m0/s1
InChIKeyRGGVDKVXLBOLNS-JQWIXIFHSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Asn-Trp (CHEBI:141425) has functional parent L-asparagine (CHEBI:17196)
Asn-Trp (CHEBI:141425) has functional parent L-tryptophan (CHEBI:16828)
Asn-Trp (CHEBI:141425) is a dipeptide (CHEBI:46761)
IUPAC Name 
L-asparaginyl-L-tryptophan
Synonyms  Source
asparaginyltryptophanChEBI
N-WChEBI
NWChEBI
(2S)-2-{[(2S)-2,4-diamino-4-oxobutanoyl]amino}-3-(1H-indol-3-yl)propanoic acidChEBI
asparaginyl-tryptophanHMDB
asn-trpChEBI
Manual XrefsDatabases
HMDB0028742HMDB
Registry NumbersSources
Reaxys:24471659Reaxys
Citations