EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H20N5O3 |
| Net Charge | +1 |
| Average Mass | 378.412 |
| Monoisotopic Mass | 378.15607 |
| SMILES | COc1cc(OC)c(OC)cc1C=[NH+]Nc1ncnc2c1nc1ccccc12 |
| InChI | InChI=1S/C20H19N5O3/c1-26-15-9-17(28-3)16(27-2)8-12(15)10-23-25-20-19-18(21-11-22-20)13-6-4-5-7-14(13)24-19/h4-11,24H,1-3H3,(H,21,22,25)/p+1 |
| InChIKey | UUSXKNMFQAMKGL-UHFFFAOYSA-O |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-16748 (CHEBI:105385) is a pyrrolopyrimidine (CHEBI:38670) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16748 | LINCS |