EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H23NO2 |
| Net Charge | 0 |
| Average Mass | 333.431 |
| Monoisotopic Mass | 333.17288 |
| SMILES | CC(C)=CCN(C(=O)C#Cc1ccccc1)[C@H](CO)c1ccccc1 |
| InChI | InChI=1S/C22H23NO2/c1-18(2)15-16-23(21(17-24)20-11-7-4-8-12-20)22(25)14-13-19-9-5-3-6-10-19/h3-12,15,21,24H,16-17H2,1-2H3/t21-/m1/s1 |
| InChIKey | PCWNDSDJZMZSNJ-OAQYLSRUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(1S)-2-hydroxy-1-phenylethyl]-N-(3-methylbut-2-enyl)-3-phenyl-2-propynamide (CHEBI:125196) is a benzenes (CHEBI:22712) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36663 | LINCS |