EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H18N4O2 |
| Net Charge | 0 |
| Average Mass | 250.302 |
| Monoisotopic Mass | 250.14298 |
| SMILES | O=C1CCCn2cc(nn2)COCC2CCCN12 |
| InChI | InChI=1S/C12H18N4O2/c17-12-4-2-5-15-7-10(13-14-15)8-18-9-11-3-1-6-16(11)12/h7,11H,1-6,8-9H2 |
| InChIKey | JBAAUGIFXKWWRR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-37279 (CHEBI:125710) is a azamacrocycle (CHEBI:52898) |
| LSM-37279 (CHEBI:125710) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37279 | LINCS |