EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H32O5 |
| Net Charge | 0 |
| Average Mass | 376.493 |
| Monoisotopic Mass | 376.22497 |
| SMILES | CCC(O)/C=C/C1C(O)CC(=O)C1C/C=C\C/C=C\C/C=C\CCC(=O)O |
| InChI | InChI=1S/C22H32O5/c1-2-17(23)14-15-19-18(20(24)16-21(19)25)12-10-8-6-4-3-5-7-9-11-13-22(26)27/h3-4,7-10,14-15,17-19,21,23,25H,2,5-6,11-13,16H2,1H3,(H,26,27)/b4-3-,9-7-,10-8-,15-14+ |
| InChIKey | BIHPRUQXOKWQGU-KBUBQVDUSA-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) |
| 20-hydroxy-E4-neuroprostane (CHEBI:174982) is a long-chain fatty acid (CHEBI:15904) |
| IUPAC Name |
|---|
| (4Z,7Z,10Z)-12-[3-hydroxy-2-[(E)-3-hydroxypent-1-enyl]-5-oxocyclopentyl]dodeca-4,7,10-trienoic acid |
| Manual Xrefs | Databases |
|---|---|
| 35032545 | ChemSpider |
| 5Z13E-15S-1115-DIHYDROXY-9-OXOPROS | MetaCyc |
| C00584 | KEGG COMPOUND |
| HMDB0012638 | HMDB |