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CHEBI:169907 - gamma-Glutamylaspartic acid

ChEBI IDCHEBI:169907
ChEBI Namegamma-Glutamylaspartic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H14N2O7
Net Charge0
Average Mass262.218
Monoisotopic Mass262.08010
SMILESN[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O
InChIInChI=1S/C9H14N2O7/c10-4(8(15)16)1-2-6(12)11-5(9(17)18)3-7(13)14/h4-5H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)(H,17,18)/t4-,5-/m0/s1
InChIKeyJTJZAUVWVBUZAU-WHFBIAKZSA-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)
gamma-Glutamylaspartic acid (CHEBI:169907) is a dipeptide (CHEBI:46761)
IUPAC Name 
(2S)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]butanedioic acid
Manual XrefsDatabases
141603ChemSpider
HMDB0030419HMDB
Registry NumbersSources
CAS:16804-55-0ChemIDplus