EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H20O2 |
| Net Charge | 0 |
| Average Mass | 196.290 |
| Monoisotopic Mass | 196.14633 |
| SMILES | CC/C=C\CCOC(=O)C/C=C\CC |
| InChI | InChI=1S/C12H20O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5-8H,3-4,9-11H2,1-2H3/b7-5-,8-6- |
| InChIKey | UZJQQWFHPLYECS-SFECMWDFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cis-3-Hexenyl cis-3-hexenoate (CHEBI:169312) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| [(Z)-hex-3-enyl] (Z)-hex-3-enoate |
| Manual Xrefs | Databases |
|---|---|
| 4940571 | ChemSpider |
| HMDB0038270 | HMDB |
| LMFA07010805 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| CAS:61444-38-0 | ChemIDplus |