EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C9H16O5S |
| Net Charge | 0 |
| Average Mass | 236.289 |
| Monoisotopic Mass | 236.07184 |
| SMILES | CSCCCCC(C(=O)O)C(O)C(=O)O |
| InChI | InChI=1S/C9H16O5S/c1-15-5-3-2-4-6(8(11)12)7(10)9(13)14/h6-7,10H,2-5H2,1H3,(H,11,12)(H,13,14) |
| InChIKey | ZIZLDVKLMYVMNX-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(4'-Methylthio)butylmalic acid (CHEBI:80967) is a dicarboxylic acid (CHEBI:35692) |
| Synonym | Source |
|---|---|
| 3-(4'-Methylthio)butylmalate | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C17219 | KEGG COMPOUND |