EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H14O4 |
| Net Charge | 0 |
| Average Mass | 210.229 |
| Monoisotopic Mass | 210.08921 |
| SMILES | CC[C@H]1Cc2oc(=O)cc(OC)c2CO1 |
| InChI | InChI=1S/C11H14O4/c1-3-7-4-10-8(6-14-7)9(13-2)5-11(12)15-10/h5,7H,3-4,6H2,1-2H3/t7-/m0/s1 |
| InChIKey | GBPMVIAHTDJTEZ-ZETCQYMHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Curvularia (ncbitaxon:5502) | - | PubMed (22233864) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pyrenocine J (CHEBI:197899) is a pyranone (CHEBI:37963) |
| IUPAC Name |
|---|
| (7S)-7-ethyl-4-methoxy-7,8-dihydro-5H-pyrano[4,3-b]pyran-2-one |
| Manual Xrefs | Databases |
|---|---|
| 31116302 | ChemSpider |