EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H22BrN5O2 |
| Net Charge | 0 |
| Average Mass | 420.311 |
| Monoisotopic Mass | 419.09569 |
| SMILES | CC(C)CNc1nc2c(c(=O)n(C)c(=O)n2C)n1Cc1cccc(Br)c1 |
| InChI | InChI=1S/C18H22BrN5O2/c1-11(2)9-20-17-21-15-14(16(25)23(4)18(26)22(15)3)24(17)10-12-6-5-7-13(19)8-12/h5-8,11H,9-10H2,1-4H3,(H,20,21) |
| InChIKey | BAJAGPSKIPXFJA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(2-methylpropylamino)purine-2,6-dione (CHEBI:108298) is a oxopurine (CHEBI:25810) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19675 | LINCS |