EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H23N6 |
| Net Charge | +1 |
| Average Mass | 311.413 |
| Monoisotopic Mass | 311.19787 |
| SMILES | CCN(CCCNc1[nH+]cnc2ncnc12)c1cccc(C)c1 |
| InChI | InChI=1S/C17H22N6/c1-3-23(14-7-4-6-13(2)10-14)9-5-8-18-16-15-17(20-11-19-15)22-12-21-16/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H2,18,19,20,21,22)/p+1 |
| InChIKey | JVTCKOKKQHNTRM-UHFFFAOYSA-O |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-26232 (CHEBI:114770) is a thiopurine (CHEBI:35666) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26232 | LINCS |