EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H19NO4 |
| Net Charge | 0 |
| Average Mass | 361.397 |
| Monoisotopic Mass | 361.13141 |
| SMILES | CCOC(=O)C1C(C)=NC2=C(C(=O)c3ccccc32)C1c1ccc(O)cc1 |
| InChI | InChI=1S/C22H19NO4/c1-3-27-22(26)17-12(2)23-20-15-6-4-5-7-16(15)21(25)19(20)18(17)13-8-10-14(24)11-9-13/h4-11,17-18,24H,3H2,1-2H3 |
| InChIKey | MEPAHLUCTQLMPF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-19902 (CHEBI:108527) is a indene (CHEBI:37910) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19902 | LINCS |