EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H13N3O |
| Net Charge | 0 |
| Average Mass | 191.234 |
| Monoisotopic Mass | 191.10586 |
| SMILES | Nc1ccc2nc(CCCO)nc2c1 |
| InChI | InChI=1S/C10H13N3O/c11-7-3-4-8-9(6-7)13-10(12-8)2-1-5-14/h3-4,6,14H,1-2,5,11H2,(H,12,13) |
| InChIKey | BVNWGDZNXNWEIB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(6-amino-1H-benzimidazol-2-yl)-1-propanol (CHEBI:104050) is a benzimidazoles (CHEBI:22715) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15408 | LINCS |