EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C15H16ClN5O |
| Net Charge | 0 |
| Average Mass | 317.780 |
| Monoisotopic Mass | 317.10434 |
| SMILES | CCC(CO)Nc1ncnc2c1cnn2-c1ccc(Cl)cc1 |
| InChI | InChI=1S/C15H16ClN5O/c1-2-11(8-22)20-14-13-7-19-21(15(13)18-9-17-14)12-5-3-10(16)4-6-12/h3-7,9,11,22H,2,8H2,1H3,(H,17,18,20) |
| InChIKey | WFGJPSRVWGNXNX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[1-(4-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]-1-butanol (CHEBI:105534) is a pyrazoles (CHEBI:26410) |
| 2-[[1-(4-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]-1-butanol (CHEBI:105534) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16897 | LINCS |