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CHEBI:168823 - Methylthiomethyl hexanoate
| Formula | C8H16O2S |
| Net Charge | 0 |
| Average Mass | 176.281 |
| Monoisotopic Mass | 176.08710 |
| SMILES | CCCCCC(=O)OCSC |
| InChI | InChI=1S/C8H16O2S/c1-3-4-5-6-8(9)10-7-11-2/h3-7H2,1-2H3 |
| InChIKey | NWSZEYNCLKNLMJ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Methylthiomethyl hexanoate (CHEBI:168823) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| methylsulanylmethyl hexanoate |
| Manual Xrefs | Databases |
|---|---|
| 151315 | ChemSpider |
| HMDB0038300 | HMDB |
| LMFA07010969 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| CAS:74758-91-1 | ChemIDplus |