EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H14O2 |
| Net Charge | 0 |
| Average Mass | 178.231 |
| Monoisotopic Mass | 178.09938 |
| SMILES | CC=CC1=C(C=CCC)COC1=O |
| InChI | InChI=1S/C11H14O2/c1-3-5-7-9-8-13-11(12)10(9)6-4-2/h4-7H,3,8H2,1-2H3 |
| InChIKey | LUTAEYHZVSOFCK-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Nigrospora (ncbitaxon:114230) | - | PubMed (24434694) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pestalafuranone F (CHEBI:198856) is a butenolide (CHEBI:50523) |
| IUPAC Name |
|---|
| 3-but-1-enyl-4-prop-1-enyl-2H-uran-5-one |