EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C11H20N2O5S |
| Net Charge | 0 |
| Average Mass | 292.357 |
| Monoisotopic Mass | 292.10929 |
| SMILES | CCCSCC(NC(=O)CCC(N)C(=O)O)C(=O)O |
| InChI | InChI=1S/C11H20N2O5S/c1-2-5-19-6-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h7-8H,2-6,12H2,1H3,(H,13,14)(H,15,16)(H,17,18) |
| InChIKey | MTFUIXBAXHURMH-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| 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-propylcysteine (CHEBI:169188) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| 2-amino-5-[(1-carboxy-2-propylsulanylethyl)amino]-5-oxopentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 13598411 | ChemSpider |
| HMDB0039096 | HMDB |