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CHEBI:171843 - 7-Hexyl-2-oxepanone
| Formula | C12H22O2 |
| Net Charge | 0 |
| Average Mass | 198.306 |
| Monoisotopic Mass | 198.16198 |
| SMILES | CCCCCCC1CCCCC(=O)O1 |
| InChI | InChI=1S/C12H22O2/c1-2-3-4-5-8-11-9-6-7-10-12(13)14-11/h11H,2-10H2,1H3 |
| InChIKey | FRTMRFCNTDDSOB-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| blood plasma (BTO:0000131) | MetaboLights (MTBLS2128) | ||
| Pooled sample (NCIT:C45910) | MetaboLights (MTBLS2128) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-Hexyl-2-oxepanone (CHEBI:171843) is a lactone (CHEBI:25000) |
| IUPAC Name |
|---|
| 7-hexyloxepan-2-one |
| Manual Xrefs | Databases |
|---|---|
| HMDB0038895 | HMDB |
| 55710 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:16429-21-3 | ChemIDplus |