EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H18O6 |
| Net Charge | 0 |
| Average Mass | 378.380 |
| Monoisotopic Mass | 378.11034 |
| SMILES | COc1c2c(cc3occ(-c4ccc5c(c4)OCO5)c(=O)c13)OC(C)(C)C=C2 |
| InChI | InChI=1S/C22H18O6/c1-22(2)7-6-13-16(28-22)9-18-19(21(13)24-3)20(23)14(10-25-18)12-4-5-15-17(8-12)27-11-26-15/h4-10H,11H2,1-3H3 |
| InChIKey | OKBNMQXBQLZQEM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-(1,3-benzodioxol-5-yl)-5-methoxy-2,2-dimethyl-6-pyrano[3,2-g][1]benzopyranone (CHEBI:109548) is a isoflavanones (CHEBI:38741) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20958 | LINCS |