EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H16O4 |
| Net Charge | 0 |
| Average Mass | 320.344 |
| Monoisotopic Mass | 320.10486 |
| SMILES | COc1ccc(-c2ccc3cccc4c3c2C(O)C(O)C4=O)cc1 |
| InChI | InChI=1S/C20H16O4/c1-24-13-8-5-11(6-9-13)14-10-7-12-3-2-4-15-16(12)17(14)19(22)20(23)18(15)21/h2-10,19-20,22-23H,1H3 |
| InChIKey | GMMBTTCHJJMJKQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2,3-dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one (CHEBI:142247) is a ortho- and peri-fused tricyclic hydrocarbon (CHEBI:51120) |
| Manual Xrefs | Databases |
|---|---|
| 8556766 | ChemSpider |
| HMDB0041463 | HMDB |