EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H22O6 |
| Net Charge | 0 |
| Average Mass | 298.335 |
| Monoisotopic Mass | 298.14164 |
| SMILES | CC=C(C)C(=O)OC1CCC(=O)OC1C=CC(O)C(C)O |
| InChI | InChI=1S/C15H22O6/c1-4-9(2)15(19)21-13-7-8-14(18)20-12(13)6-5-11(17)10(3)16/h4-6,10-13,16-17H,7-8H2,1-3H3 |
| InChIKey | WEDIEMBZPFJDNC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-4450 (CHEBI:93876) is a δ-lactone (CHEBI:18946) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4450 | LINCS |