EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H20O7 |
| Net Charge | 0 |
| Average Mass | 360.362 |
| Monoisotopic Mass | 360.12090 |
| SMILES | CC1CC(=O)C2C(O)(C1)CC(O)C13OC1c1c(O)cccc1C(=O)C23O |
| InChI | InChI=1S/C19H20O7/c1-8-5-11(21)14-17(24,6-8)7-12(22)19-16(26-19)13-9(3-2-4-10(13)20)15(23)18(14,19)25/h2-4,8,12,14,16,20,22,24-25H,5-7H2,1H3 |
| InChIKey | FXOBIDROVMXPBW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-4337 (CHEBI:93810) is a tetralins (CHEBI:36786) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4337 | LINCS |