EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H14O2 |
| Net Charge | 0 |
| Average Mass | 142.198 |
| Monoisotopic Mass | 142.09938 |
| SMILES | CCC/C=C/CCC(=O)O |
| InChI | InChI=1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h4-5H,2-3,6-7H2,1H3,(H,9,10)/b5-4+ |
| InChIKey | PFHBCQFBHMBAMC-SNAWJCMRSA-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) |
| (E)-4-Octenoic acid (CHEBI:180287) is a medium-chain fatty acid (CHEBI:59554) |
| IUPAC Name |
|---|
| (E)-oct-4-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 4938791 | ChemSpider |
| LMFA01030951 | LIPID MAPS |
| HMDB0039793 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:18294-89-8 | ChemIDplus |