EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H13N3O2 |
| Net Charge | 0 |
| Average Mass | 267.288 |
| Monoisotopic Mass | 267.10078 |
| SMILES | c1ccc2nc(NCc3ccc4c(c3)OCO4)nc2c1 |
| InChI | InChI=1S/C15H13N3O2/c1-2-4-12-11(3-1)17-15(18-12)16-8-10-5-6-13-14(7-10)20-9-19-13/h1-7H,8-9H2,(H2,16,17,18) |
| InChIKey | QXKFXLLCKVUQPZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,3-benzodioxol-5-ylmethyl)-1H-benzimidazol-2-amine (CHEBI:121968) is a benzodioxoles (CHEBI:38298) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33411 | LINCS |