EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H12O4 |
| Net Charge | 0 |
| Average Mass | 208.213 |
| Monoisotopic Mass | 208.07356 |
| SMILES | CC(=O)C=CC1=C(C=CCO)C(=O)OC1 |
| InChI | InChI=1S/C11H12O4/c1-8(13)4-5-9-7-15-11(14)10(9)3-2-6-12/h2-5,12H,6-7H2,1H3 |
| InChIKey | MTIXLNGBTSSLAE-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Nigrospora (ncbitaxon:114230) | - | PubMed (24434694) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pestalafuranone H (CHEBI:197607) is a butenolide (CHEBI:50523) |
| IUPAC Name |
|---|
| 4-(3-hydroxyprop-1-enyl)-3-(3-oxobut-1-enyl)-2H-uran-5-one |