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CHEBI:168106 - gamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide

ChEBI IDCHEBI:168106
ChEBI Namegamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18N2O6S
Net Charge0
Average Mass306.340
Monoisotopic Mass306.08856
SMILESC/C=C/S(=O)CC(NC(=O)CCC(N)C(=O)O)C(=O)O
InChIInChI=1S/C11H18N2O6S/c1-2-5-20(19)6-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h2,5,7-8H,3-4,6,12H2,1H3,(H,13,14)(H,15,16)(H,17,18)/b5-2+
InChIKeyLMNDKWXDMBGGAL-GORDUTHDSA-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-Glutamyl-S-(1-propenyl)cysteine sulfoxide (CHEBI:168106) is a dipeptide (CHEBI:46761)
IUPAC Name 
2-amino-5-[[1-carboxy-2-[(E)-prop-1-enyl]sulinylethyl]amino]-5-oxopentanoic acid
Manual XrefsDatabases
13392987ChemSpider
HMDB0031870HMDB