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CHEBI:168607 - Asparaginyl-Histidine

ChEBI IDCHEBI:168607
ChEBI NameAsparaginyl-Histidine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H15N5O4
Net Charge0
Average Mass269.261
Monoisotopic Mass269.11240
SMILESNC(=O)CC(N)C(=O)NC(Cc1cncn1)C(=O)O
InChIInChI=1S/C10H15N5O4/c11-6(2-8(12)16)9(17)15-7(10(18)19)1-5-3-13-4-14-5/h3-4,6-7H,1-2,11H2,(H2,12,16)(H,13,14)(H,15,17)(H,18,19)
InChIKeyFFMIYIMKQIMDPK-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)
Asparaginyl-Histidine (CHEBI:168607) is a dipeptide (CHEBI:46761)
IUPAC Name 
2-[(2,4-diamino-4-oxobutanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid
Manual XrefsDatabases
HMDB0028733HMDB
16568262ChemSpider