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CHEBI:159508 - Asn-Ala-Trp

ChEBI IDCHEBI:159508
ChEBI NameAsn-Ala-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23N5O5
Net Charge0
Average Mass389.412
Monoisotopic Mass389.16992
SMILESC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C18H23N5O5/c1-9(22-17(26)12(19)7-15(20)24)16(25)23-14(18(27)28)6-10-8-21-13-5-3-2-4-11(10)13/h2-5,8-9,12,14,21H,6-7,19H2,1H3,(H2,20,24)(H,22,26)(H,23,25)(H,27,28)/t9-,12-,14-/m0/s1
InChIKeyNTXNUXPCNRDMAF-WFBYXXMGSA-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-Ala-Trp (CHEBI:159508) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoic acid