EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C27H24N4O5 |
| Net Charge | 0 |
| Average Mass | 484.512 |
| Monoisotopic Mass | 484.17467 |
| SMILES | COc1ccc2c(c1)C(=O)N(Cc1ccco1)C(=O)C2=CNc1c(C)n(C)n(-c2ccccc2)c1=O |
| InChI | InChI=1S/C27H24N4O5/c1-17-24(27(34)31(29(17)2)18-8-5-4-6-9-18)28-15-23-21-12-11-19(35-3)14-22(21)25(32)30(26(23)33)16-20-10-7-13-36-20/h4-15,28H,16H2,1-3H3 |
| InChIKey | NVWFNGRWBYLOQL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]methylidene]-2-(2-furanylmethyl)-7-methoxyisoquinoline-1,3-dione (CHEBI:116079) is a isoquinolines (CHEBI:24922) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27535 | LINCS |