EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H22O2 |
| Net Charge | 0 |
| Average Mass | 198.306 |
| Monoisotopic Mass | 198.16198 |
| SMILES | CC(C)=CCCC(C)CCOCC=O |
| InChI | InChI=1S/C12H22O2/c1-11(2)5-4-6-12(3)7-9-14-10-8-13/h5,8,12H,4,6-7,9-10H2,1-3H3 |
| InChIKey | LMETVDMCIJNNKH-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) |
| [(3,7-Dimethyl-6-octenyl)oxy]acetaldehyde (CHEBI:171839) is a monoterpenoid (CHEBI:25409) |
| IUPAC Name |
|---|
| 2-(3,7-dimethyloct-6-enoxy)acetaldehyde |
| Manual Xrefs | Databases |
|---|---|
| HMDB0041449 | HMDB |
| 55330 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:7492-67-3 | ChemIDplus |