EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H13N3O2 |
| Net Charge | 0 |
| Average Mass | 279.299 |
| Monoisotopic Mass | 279.10078 |
| SMILES | Cc1nnc(Nc2ccc3c(c2)OCO3)c2ccccc12 |
| InChI | InChI=1S/C16H13N3O2/c1-10-12-4-2-3-5-13(12)16(19-18-10)17-11-6-7-14-15(8-11)21-9-20-14/h2-8H,9H2,1H3,(H,17,19) |
| InChIKey | IBDKKLFMDGNLGZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,3-benzodioxol-5-yl)-4-methyl-1-phthalazinamine (CHEBI:117183) is a phthalazines (CHEBI:38768) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28632 | LINCS |