EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:189116 - Triethylene glycol bis(2-ethylhexanoate)
| Formula | C22H42O6 |
| Net Charge | 0 |
| Average Mass | 402.572 |
| Monoisotopic Mass | 402.29814 |
| SMILES | CCCCC(CC)C(=O)OCCOCCOCCOC(=O)C(CC)CCCC |
| InChI | InChI=1S/C22H42O6/c1-5-9-11-19(7-3)21(23)27-17-15-25-13-14-26-16-18-28-22(24)20(8-4)12-10-6-2/h19-20H,5-18H2,1-4H3 |
| InChIKey | FRQDZJMEHSJOPU-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Arabidopsis thaliana (ncbitaxon:3702) | leaf (BTO:0000713) | MetaboLights (MTBLS3997) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Triethylene glycol bis(2-ethylhexanoate) (CHEBI:189116) is a fatty acid ester (CHEBI:35748) |
| IUPAC Name |
|---|
| 2-[2-[2-(2-ethylhexanoyloxy)ethoxy]ethoxy]ethyl 2-ethylhexanoate |