EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H22O6 |
| Net Charge | 0 |
| Average Mass | 394.423 |
| Monoisotopic Mass | 394.14164 |
| SMILES | COc1cc2c(cc1OC)-c1c(oc3c4c(ccc3c1=O)OC(C(C)C)C4)CO2 |
| InChI | InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,11,16H,8,10H2,1-4H3 |
| InChIKey | BHCBWJBSVOKHRJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-4404 (CHEBI:93848) is a rotenones (CHEBI:72581) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4404 | LINCS |