EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H18N4O5 |
| Net Charge | 0 |
| Average Mass | 358.354 |
| Monoisotopic Mass | 358.12772 |
| SMILES | Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccc([N+](=O)[O-])o2)cc1C |
| InChI | InChI=1S/C17H18N4O5/c1-11-3-4-13(9-12(11)2)19-15(22)6-7-16(23)20-18-10-14-5-8-17(26-14)21(24)25/h3-5,8-10H,6-7H2,1-2H3,(H,19,22)(H,20,23) |
| InChIKey | UKQWTRJZFLXIQL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(3,4-dimethylphenyl)-N'-[(5-nitro-2-furanyl)methylideneamino]butanediamide (CHEBI:92319) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-2387 | LINCS |