EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H17N5O4 |
| Net Charge | 0 |
| Average Mass | 355.354 |
| Monoisotopic Mass | 355.12805 |
| SMILES | O=[N+]([O-])c1ccc(NN=C2CCCCC2c2ccccn2)c([N+](=O)[O-])c1 |
| InChI | InChI=1S/C17H17N5O4/c23-21(24)12-8-9-16(17(11-12)22(25)26)20-19-15-7-2-1-5-13(15)14-6-3-4-10-18-14/h3-4,6,8-11,13,20H,1-2,5,7H2 |
| InChIKey | OXWJCYWFEMNOSV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2,4-dinitro-N-[[2-(2-pyridinyl)cyclohexylidene]amino]aniline (CHEBI:120625) is a C-nitro compound (CHEBI:35716) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32067 | LINCS |