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CHEBI:160831 - Asp-Pro-Asn

ChEBI IDCHEBI:160831
ChEBI NameAsp-Pro-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20N4O7
Net Charge0
Average Mass344.324
Monoisotopic Mass344.13320
SMILESNC(=O)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)O)C(=O)O
InChIInChI=1S/C13H20N4O7/c14-6(4-10(19)20)12(22)17-3-1-2-8(17)11(21)16-7(13(23)24)5-9(15)18/h6-8H,1-5,14H2,(H2,15,18)(H,16,21)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1
InChIKeyBWJZSLQJNBSUPM-FXQIFTODSA-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)
Asp-Pro-Asn (CHEBI:160831) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[(2S)-2-[[(1S)-3-amino-1-carboxy-3-oxopropyl]carbamoyl]pyrrolidin-1-yl]-4-oxobutanoic acid
Manual XrefsDatabases
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