EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H20O5 |
| Net Charge | 0 |
| Average Mass | 364.397 |
| Monoisotopic Mass | 364.13107 |
| SMILES | CC(C)=CCc1cc(CC2=C(c3ccc(O)cc3)C(=O)OC2=O)ccc1O |
| InChI | InChI=1S/C22H20O5/c1-13(2)3-5-16-11-14(4-10-19(16)24)12-18-20(22(26)27-21(18)25)15-6-8-17(23)9-7-15/h3-4,6-11,23-24H,5,12H2,1-2H3 |
| InChIKey | BFDQKBYABNXUJF-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus terreus (ncbitaxon:33178) | - | PubMed (20823603) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Asperterone (CHEBI:204294) is a phenols (CHEBI:33853) |
| IUPAC Name |
|---|
| 3-[[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl]-4-(4-hydroxyphenyl)uran-2,5-dione |
| Manual Xrefs | Databases |
|---|---|
| 78434791 | ChemSpider |