EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17N3O3 |
| Net Charge | 0 |
| Average Mass | 323.352 |
| Monoisotopic Mass | 323.12699 |
| SMILES | CCCc1nc2ccccc2c(=O)n1NC=C1C=CC(=O)C=C1O |
| InChI | InChI=1S/C18H17N3O3/c1-2-5-17-20-15-7-4-3-6-14(15)18(24)21(17)19-11-12-8-9-13(22)10-16(12)23/h3-4,6-11,19,23H,2,5H2,1H3 |
| InChIKey | CMDSKYZSZYZOEG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-2-propyl-4-quinazolinone (CHEBI:120440) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31883 | LINCS |