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CHEBI:168646 - N-gamma-Glutamyl-S-allylcysteine

ChEBI IDCHEBI:168646
ChEBI NameN-gamma-Glutamyl-S-allylcysteine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18N2O5S
Net Charge0
Average Mass290.341
Monoisotopic Mass290.09364
SMILESC=CCSCC(NC(=O)CCC(N)C(=O)O)C(=O)O
InChIInChI=1S/C11H18N2O5S/c1-2-5-19-6-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h2,7-8H,1,3-6,12H2,(H,13,14)(H,15,16)(H,17,18)
InChIKeyFUTHBNRZCFKVQZ-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)
N-gamma-Glutamyl-S-allylcysteine (CHEBI:168646) is a dipeptide (CHEBI:46761)
IUPAC Name 
2-amino-5-[(1-carboxy-2-prop-2-enylsulanylethyl)amino]-5-oxopentanoic acid
Manual XrefsDatabases
9368976ChemSpider
HMDB0031874HMDB