EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H18N2O3S |
| Net Charge | 0 |
| Average Mass | 234.321 |
| Monoisotopic Mass | 234.10381 |
| SMILES | CCC(C)C(NC(=O)C(N)CS)C(=O)O |
| InChI | InChI=1S/C9H18N2O3S/c1-3-5(2)7(9(13)14)11-8(12)6(10)4-15/h5-7,15H,3-4,10H2,1-2H3,(H,11,12)(H,13,14) |
| InChIKey | VBIIZCXWOZDIHS-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ovis aries (ncbitaxon:9940) | Rumen (NCIT:C98778) | MetaboLights (MTBLS3683) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cysteinyl-Isoleucine (CHEBI:192307) is a dipeptide (CHEBI:46761) |
| IUPAC Name |
|---|
| 2-[(2-amino-3-sulanylpropanoyl)amino]-3-methylpentanoic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0028778 | HMDB |
| 16568284 | ChemSpider |