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CHEBI:160086 - Asn-Ser-Gln

ChEBI IDCHEBI:160086
ChEBI NameAsn-Ser-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H21N5O7
Net Charge0
Average Mass347.328
Monoisotopic Mass347.14410
SMILESNC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C12H21N5O7/c13-5(3-9(15)20)10(21)17-7(4-18)11(22)16-6(12(23)24)1-2-8(14)19/h5-7,18H,1-4,13H2,(H2,14,19)(H2,15,20)(H,16,22)(H,17,21)(H,23,24)/t5-,6-,7-/m0/s1
InChIKeyJWQWPRCDYWNVNM-ACZMJKKPSA-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-Ser-Gln (CHEBI:160086) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoic acid