EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:172102 - Ethyl tridecanoate
| Formula | C15H30O2 |
| Net Charge | 0 |
| Average Mass | 242.403 |
| Monoisotopic Mass | 242.22458 |
| SMILES | CCCCCCCCCCCCC(=O)OCC |
| InChI | InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-14-15(16)17-4-2/h3-14H2,1-2H3 |
| InChIKey | QJYYMNOTJXIOBP-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) |
| Ethyl tridecanoate (CHEBI:172102) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| ethyl tridecanoate |
| Manual Xrefs | Databases |
|---|---|
| 107061 | ChemSpider |
| HMDB0059833 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:28267-29-0 | ChemIDplus |