EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H25N3O3 |
| Net Charge | 0 |
| Average Mass | 379.460 |
| Monoisotopic Mass | 379.18959 |
| SMILES | O=C(CN1C(=O)COc2ccccc21)NCCCN1CCc2ccccc2C1 |
| InChI | InChI=1S/C22H25N3O3/c26-21(15-25-19-8-3-4-9-20(19)28-16-22(25)27)23-11-5-12-24-13-10-17-6-1-2-7-18(17)14-24/h1-4,6-9H,5,10-16H2,(H,23,26) |
| InChIKey | QNQGZBZEMUQMCU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide (CHEBI:120474) is a benzoxazine (CHEBI:46969) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31917 | LINCS |