EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H17NO4 |
| Net Charge | 0 |
| Average Mass | 275.304 |
| Monoisotopic Mass | 275.11576 |
| SMILES | CC(=O)Oc1ccc2occ(C(=O)CCN(C)C)c2c1 |
| InChI | InChI=1S/C15H17NO4/c1-10(17)20-11-4-5-15-12(8-11)13(9-19-15)14(18)6-7-16(2)3/h4-5,8-9H,6-7H2,1-3H3 |
| InChIKey | GBMFUOJPDAIZDH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| acetic acid [3-[3-(dimethylamino)-1-oxopropyl]-5-benzofuranyl] ester (CHEBI:94299) is a benzoate ester (CHEBI:36054) |
| acetic acid [3-[3-(dimethylamino)-1-oxopropyl]-5-benzofuranyl] ester (CHEBI:94299) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4931 | LINCS |