EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H21NO4 |
| Net Charge | 0 |
| Average Mass | 327.380 |
| Monoisotopic Mass | 327.14706 |
| SMILES | O=C(OC(C(=O)NC1CCCCC1)c1ccccc1)c1ccco1 |
| InChI | InChI=1S/C19H21NO4/c21-18(20-15-10-5-2-6-11-15)17(14-8-3-1-4-9-14)24-19(22)16-12-7-13-23-16/h1,3-4,7-9,12-13,15,17H,2,5-6,10-11H2,(H,20,21) |
| InChIKey | MHIKKOAYWFREPC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-furancarboxylic acid [2-(cyclohexylamino)-2-oxo-1-phenylethyl] ester (CHEBI:121064) has functional parent benzyl alcohol (CHEBI:17987) |
| 2-furancarboxylic acid [2-(cyclohexylamino)-2-oxo-1-phenylethyl] ester (CHEBI:121064) is a carboxylic ester (CHEBI:33308) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32507 | LINCS |