EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H17N3O4 |
| Net Charge | 0 |
| Average Mass | 351.362 |
| Monoisotopic Mass | 351.12191 |
| SMILES | Cn1nc(CC(=O)Nc2ccc3c(c2)OCCO3)c2ccccc2c1=O |
| InChI | InChI=1S/C19H17N3O4/c1-22-19(24)14-5-3-2-4-13(14)15(21-22)11-18(23)20-12-6-7-16-17(10-12)26-9-8-25-16/h2-7,10H,8-9,11H2,1H3,(H,20,23) |
| InChIKey | XYEVXHKHHRCOPM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide (CHEBI:107764) is a phthalazines (CHEBI:38768) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19141 | LINCS |