EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H32O4 |
| Net Charge | 0 |
| Average Mass | 336.472 |
| Monoisotopic Mass | 336.23006 |
| SMILES | CC/C=C\C/C=C\C/C=C\CC(O)C(O)C/C=C\CCCC(=O)O |
| InChI | InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-12-15-18(21)19(22)16-13-10-11-14-17-20(23)24/h3-4,6-7,9-10,12-13,18-19,21-22H,2,5,8,11,14-17H2,1H3,(H,23,24)/b4-3-,7-6-,12-9-,13-10- |
| InChIKey | NXFSSCYFERVGJQ-JJUYGIQRSA-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) |
| 8,9-DiHETE (CHEBI:165287) is a hydroxy fatty acid (CHEBI:24654) |
| 8,9-DiHETE (CHEBI:165287) is a polyunsaturated fatty acid (CHEBI:26208) |
| IUPAC Name |
|---|
| (5Z,11Z,14Z,17Z)-8,9-dihydroxyicosa-5,11,14,17-tetraenoic acid |
| Manual Xrefs | Databases |
|---|---|
| LMFA03060076 | LIPID MAPS |
| 17220801 | ChemSpider |