EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H32O2 |
| Net Charge | 0 |
| Average Mass | 280.452 |
| Monoisotopic Mass | 280.24023 |
| SMILES | C=CCC/C=C/CCCCCCCCCCCC(=O)O |
| InChI | InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2,5-6H,1,3-4,7-17H2,(H,19,20)/b6-5+ |
| InChIKey | ZSCQSJYYQBIMGK-AATRIKPKSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 13E,17-Octadecadienoic acid (CHEBI:165454) is a octadecadienoic acid (CHEBI:25627) |
| IUPAC Name |
|---|
| (13E)-octadeca-13,17-dienoic acid |
| Manual Xrefs | Databases |
|---|---|
| 4471879 | ChemSpider |
| LMFA01030303 | LIPID MAPS |