CHEBI:169447 - Glutaminylaspartic acid

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ChEBI Name Glutaminylaspartic acid
ChEBI ID CHEBI:169447
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H15N3O6
Net Charge 0
Average Mass 261.234
Monoisotopic Mass 261.09609
InChI InChI=1S/C9H15N3O6/c10-4(1-2-6(11)13)8(16)12-5(9(17)18)3-7(14)15/h4-5H,1-3,10H2,(H2,11,13)(H,12,16)(H,14,15)(H,17,18)
InChIKey SSHIXEILTLPAQT-UHFFFAOYSA-N
SMILES O=C(NC(CC(O)=O)C(O)=O)C(N)CCC(=O)N
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
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 Glutaminylaspartic acid (CHEBI:169447) is a dipeptide (CHEBI:46761)
IUPAC Name
2-[(2,5-diamino-5-oxopentanoyl)amino]butanedioic acid
Manual Xrefs Databases
16568297 ChemSpider
HMDB0029145 HMDB
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