EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H16N5 |
| Net Charge | +1 |
| Average Mass | 218.284 |
| Monoisotopic Mass | 218.14002 |
| SMILES | CC1CCN(c2[nH+]cnc3ncnc23)CC1 |
| InChI | InChI=1S/C11H15N5/c1-8-2-4-16(5-3-8)11-9-10(13-6-12-9)14-7-15-11/h6-8H,2-5H2,1H3,(H,12,13,14,15)/p+1 |
| InChIKey | OUNRAWGIKYOXGG-UHFFFAOYSA-O |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-31454 (CHEBI:120011) is a thiopurine (CHEBI:35666) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31454 | LINCS |