EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H22O2 |
| Net Charge | 0 |
| Average Mass | 222.328 |
| Monoisotopic Mass | 222.16198 |
| SMILES | C=C1CCC2C(CC2(C)C)C(=O)CCC1O |
| InChI | InChI=1S/C14H22O2/c1-9-4-5-11-10(8-14(11,2)3)13(16)7-6-12(9)15/h10-12,15H,1,4-8H2,2-3H3 |
| InChIKey | BSFUDCIRZBAPDS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-hydroxy-11,11-dimethyl-4-methylene-8-bicyclo[7.2.0]undecanone (CHEBI:108586) is a organic hydroxy compound (CHEBI:33822) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19964 | LINCS |
| HMDB0036791 | HMDB |