EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H15NO6 |
| Net Charge | 0 |
| Average Mass | 281.264 |
| Monoisotopic Mass | 281.08994 |
| SMILES | CCC/C=C/c1oc2c(c(=O)c1O)C(=O)N[C@]2(O)CO |
| InChI | InChI=1S/C13H15NO6/c1-2-3-4-5-7-9(16)10(17)8-11(20-7)13(19,6-15)14-12(8)18/h4-5,15-16,19H,2-3,6H2,1H3,(H,14,18)/b5-4+/t13-/m0/s1 |
| InChIKey | OOWLLHHEDDGILU-IHVVCDCBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus terreus (ncbitaxon:33178) | - | PubMed (32077283) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pyranterrone G (CHEBI:225874) is a pyranone (CHEBI:37963) |
| IUPAC Name |
|---|
| 3,7-dihydroxy-7-(hydroxymethyl)-2-[(E)-pent-1-enyl]-6H-pyrano[2,3-c]pyrrole-4,5-dione |