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CHEBI:161326 - Phe-Asn-Gln

ChEBI IDCHEBI:161326
ChEBI NamePhe-Asn-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25N5O6
Net Charge0
Average Mass407.427
Monoisotopic Mass407.18048
SMILESNC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O
InChIInChI=1S/C18H25N5O6/c19-11(8-10-4-2-1-3-5-10)16(26)23-13(9-15(21)25)17(27)22-12(18(28)29)6-7-14(20)24/h1-5,11-13H,6-9,19H2,(H2,20,24)(H2,21,25)(H,22,27)(H,23,26)(H,28,29)/t11-,12-,13-/m0/s1
InChIKeyMRNRMSDVVSKPGM-AVGNSLFASA-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)
Phe-Asn-Gln (CHEBI:161326) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoic acid