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CHEBI:170090 - Citronellyl hexanoate
| Formula | C16H30O2 |
| Net Charge | 0 |
| Average Mass | 254.414 |
| Monoisotopic Mass | 254.22458 |
| SMILES | CCCCCC(=O)OCCC(C)CCC=C(C)C |
| InChI | InChI=1S/C16H30O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,15H,5-8,10-13H2,1-4H3 |
| InChIKey | KNYRCCKTQMBSFP-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| HeLa cell;NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| NIH-3T3 cell (BTO:0000944) | MetaboLights (MTBLS78) | ||
| Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | ||
| HeLa cell (BTO:0000567) | MetaboLights (MTBLS78) | ||
| Mus musculus (ncbitaxon:10090) | Hepa-RG cell (BTO:0005736) | MetaboLights (MTBLS78) | Strain: C57BL/6J [EFO:0000606] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Citronellyl hexanoate (CHEBI:170090) is a carboxylic ester (CHEBI:33308) |
| IUPAC Name |
|---|
| 3,7-dimethyloct-6-enyl hexanoate |
| Manual Xrefs | Databases |
|---|---|
| 102474 | ChemSpider |
| HMDB0038958 | HMDB |
| LMFA07010816 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| CAS:10580-25-3 | ChemIDplus |