CHEBI:177259 - Phenylalanyl-Aspartate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Phenylalanyl-Aspartate
ChEBI ID CHEBI:177259
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H16N2O5
Net Charge 0
Average Mass 280.280
Monoisotopic Mass 280.10592
InChI InChI=1S/C13H16N2O5/c14-9(6-8-4-2-1-3-5-8)12(18)15-10(13(19)20)7-11(16)17/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)
InChIKey HWMGTNOVUDIKRE-UHFFFAOYSA-N
SMILES O=C(NC(CC(O)=O)C(O)=O)C(N)CC1=CC=CC=C1
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in liver (BTO:0000759). of strain C57BL/6J [EFO:0000606]
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Phenylalanyl-Aspartate (CHEBI:177259) is a dipeptide (CHEBI:46761)
IUPAC Name
2-[(2-amino-3-phenylpropanoyl)amino]butanedioic acid
Manual Xrefs Databases
296912 ChemSpider
HMDB0028991 HMDB
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