EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H17N3O4 |
| Net Charge | 0 |
| Average Mass | 375.384 |
| Monoisotopic Mass | 375.12191 |
| SMILES | COc1ccccc1-n1nc(C(=O)NCc2ccco2)c2ccccc2c1=O |
| InChI | InChI=1S/C21H17N3O4/c1-27-18-11-5-4-10-17(18)24-21(26)16-9-3-2-8-15(16)19(23-24)20(25)22-13-14-7-6-12-28-14/h2-12H,13H2,1H3,(H,22,25) |
| InChIKey | BFAMULUPCYNQRW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-furanylmethyl)-3-(2-methoxyphenyl)-4-oxo-1-phthalazinecarboxamide (CHEBI:109090) is a phthalazines (CHEBI:38768) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20488 | LINCS |