EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H31NO |
| Net Charge | 0 |
| Average Mass | 289.463 |
| Monoisotopic Mass | 289.24056 |
| SMILES | COc1ccccc1CCNC1CCC(C(C)(C)C)CC1 |
| InChI | InChI=1S/C19H31NO/c1-19(2,3)16-9-11-17(12-10-16)20-14-13-15-7-5-6-8-18(15)21-4/h5-8,16-17,20H,9-14H2,1-4H3 |
| InChIKey | WHIGUJZLRRODIW-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-tert-butyl-N-[2-(2-methoxyphenyl)ethyl]-1-cyclohexanamine (CHEBI:109627) is a primary amine (CHEBI:32877) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21055 | LINCS |