EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H27NO2 |
| Net Charge | 0 |
| Average Mass | 301.430 |
| Monoisotopic Mass | 301.20418 |
| SMILES | C=CCCCCCCC[C@H]1C(=O)O[C@@H]1CCc1cccnc1 |
| InChI | InChI=1S/C19H27NO2/c1-2-3-4-5-6-7-8-11-17-18(22-19(17)21)13-12-16-10-9-14-20-15-16/h2,9-10,14-15,17-18H,1,3-8,11-13H2/t17-,18-/m1/s1 |
| InChIKey | WBHVHPLFRGISDD-QZTJIDSGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3R,4R)-A2-32-01 (CHEBI:86964) is a 3-(non-8-en-1-yl)-4-[2-(pyridin-3-yl)ethyl]oxetan-2-one (CHEBI:86967) |
| Incoming Relation(s) |
| A2-32-01 (CHEBI:86341) has part (3R,4R)-A2-32-01 (CHEBI:86964) |
| IUPAC Name |
|---|
| (3R,4R)-3-(non-8-en-1-yl)-4-[2-(pyridin-3-yl)ethyl]oxetan-2-one |