EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C32H28O8 |
| Net Charge | 0 |
| Average Mass | 540.568 |
| Monoisotopic Mass | 540.17842 |
| SMILES | COc1cc(-c2coc3cc(OCc4ccccc4)c(OC)c(O)c3c2=O)cc(OCc2ccccc2)c1OC |
| InChI | InChI=1S/C32H28O8/c1-35-25-14-22(15-26(31(25)36-2)38-17-20-10-6-4-7-11-20)23-19-40-24-16-27(39-18-21-12-8-5-9-13-21)32(37-3)30(34)28(24)29(23)33/h4-16,19,34H,17-18H2,1-3H3 |
| InChIKey | BDFCYBFDARSRDM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(3,4-dimethoxy-5-phenylmethoxyphenyl)-5-hydroxy-6-methoxy-7-phenylmethoxy-1-benzopyran-4-one (CHEBI:107648) is a 4'-methoxyisoflavones (CHEBI:133959) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19019 | LINCS |