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CHEBI:169417 - Hydroxyprolyl-Asparagine

ChEBI IDCHEBI:169417
ChEBI NameHydroxyprolyl-Asparagine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H15N3O5
Net Charge0
Average Mass245.235
Monoisotopic Mass245.10117
SMILESNC(=O)CC(NC(=O)C1CC(O)CN1)C(=O)O
InChIInChI=1S/C9H15N3O5/c10-7(14)2-6(9(16)17)12-8(15)5-1-4(13)3-11-5/h4-6,11,13H,1-3H2,(H2,10,14)(H,12,15)(H,16,17)
InChIKeyGUZRMGFLLJQHCW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Hydroxyprolyl-Asparagine (CHEBI:169417) is a peptide (CHEBI:16670)
IUPAC Name 
4-amino-2-[(4-hydroxypyrrolidine-2-carbonyl)amino]-4-oxobutanoic acid
Manual XrefsDatabases
HMDB0028858HMDB
35032799ChemSpider