EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:107641 - 7-(2-chloroethyl)-1,3-dimethylpurine-2,6-dione
| Formula | C9H11ClN4O2 |
| Net Charge | 0 |
| Average Mass | 242.666 |
| Monoisotopic Mass | 242.05705 |
| SMILES | Cn1c(=O)c2c(ncn2CCCl)n(C)c1=O |
| InChI | InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3 |
| InChIKey | QCIARNIKNKKHFH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-(2-chloroethyl)-1,3-dimethylpurine-2,6-dione (CHEBI:107641) is a oxopurine (CHEBI:25810) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19003 | LINCS |