EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H18O4 |
| Net Charge | 0 |
| Average Mass | 238.283 |
| Monoisotopic Mass | 238.12051 |
| SMILES | C=C[C@H](O)[C@@H](O)C1=C(/C=C/CCC)COC1=O |
| InChI | InChI=1S/C13H18O4/c1-3-5-6-7-9-8-17-13(16)11(9)12(15)10(14)4-2/h4,6-7,10,12,14-15H,2-3,5,8H2,1H3/b7-6+/t10-,12+/m0/s1 |
| InChIKey | COIHTPZGABOQCQ-SKBQGCEYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Camaropsspecies (ncbitaxon:1933436) | - | DOI (10.1016/j.phytol.2016.08.007) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-((E)-pent-1-enyl)-3-((1S,2S)-1,2-dihydroxybut-3-enyl)-5H-furan-2-one (CHEBI:224151) is a butenolide (CHEBI:50523) |
| IUPAC Name |
|---|
| 4-[(1S,2S)-1,2-dihydroxybut-3-enyl]-3-[(E)-pent-1-enyl]-2H-uran-5-one |
| Manual Xrefs | Databases |
|---|---|
| 78442249 | ChemSpider |