EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:171862 - xi-Tetrahydro-3-nonyl-2H-pyran-2-one
| Formula | C14H26O2 |
| Net Charge | 0 |
| Average Mass | 226.360 |
| Monoisotopic Mass | 226.19328 |
| SMILES | CCCCCCCCCC1CCCOC1=O |
| InChI | InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-10-13-11-9-12-16-14(13)15/h13H,2-12H2,1H3 |
| InChIKey | XLKRUURGHWUVNG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| Pooled sample (NCIT:C45910) | MetaboLights (MTBLS2128) | ||
| blood plasma (BTO:0000131) | MetaboLights (MTBLS2128) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| xi-Tetrahydro-3-nonyl-2H-pyran-2-one (CHEBI:171862) is a δ-lactone (CHEBI:18946) |
| IUPAC Name |
|---|
| 3-nonyloxan-2-one |
| Manual Xrefs | Databases |
|---|---|
| 35014446 | ChemSpider |
| HMDB0037633 | HMDB |