EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H32O6 |
| Net Charge | 0 |
| Average Mass | 380.481 |
| Monoisotopic Mass | 380.21989 |
| SMILES | CCCCCCCC(=O)c1cc(OC)c(OC)c(OC)c1CC(=O)OCC |
| InChI | InChI=1S/C21H32O6/c1-6-8-9-10-11-12-17(22)15-13-18(24-3)21(26-5)20(25-4)16(15)14-19(23)27-7-2/h13H,6-12,14H2,1-5H3 |
| InChIKey | WCYMJQXRLIDSAQ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Phyllostachys violascens (ncbitaxon:1903417) | stem (BTO:0001300) | MetaboLights (MTBLS3970) | Strain: Phyllostachys violascens cv. Viridisulcata |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ethyl (2,3,4-trimethoxy-6-octanoylphenyl)acetate (CHEBI:188707) is a aromatic ketone (CHEBI:76224) |
| IUPAC Name |
|---|
| ethyl 2-(2,3,4-trimethoxy-6-octanoylphenyl)acetate |