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CHEBI:168042 - L-gamma-Glutamyl-S-allylthio-L-cysteine

ChEBI IDCHEBI:168042
ChEBI NameL-gamma-Glutamyl-S-allylthio-L-cysteine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18N2O5S2
Net Charge0
Average Mass322.408
Monoisotopic Mass322.06571
SMILESC=CCSSCC(NC(=O)CCC(N)C(=O)O)C(=O)O
InChIInChI=1S/C11H18N2O5S2/c1-2-5-19-20-6-8(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)
InChIKeyVTEHWEWRSAXLHY-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)
L-gamma-Glutamyl-S-allylthio-L-cysteine (CHEBI:168042) is a dipeptide (CHEBI:46761)
IUPAC Name 
2-amino-5-[[1-carboxy-2-(prop-2-enyldisulanyl)ethyl]amino]-5-oxopentanoic acid
Manual XrefsDatabases
35014594ChemSpider
HMDB0038515HMDB