EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H32O5 |
| Net Charge | 0 |
| Average Mass | 352.471 |
| Monoisotopic Mass | 352.22497 |
| SMILES | CC/C=C\C[C@H](O)/C=C/[C@@H]1[C@H](C/C=C\CCCC(=O)O)[C@@H](O)C[C@H]1O |
| InChI | InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h3-4,6-7,12-13,15-19,21-23H,2,5,8-11,14H2,1H3,(H,24,25)/b6-3-,7-4-,13-12+/t15-,16-,17+,18-,19+/m0/s1 |
| InChIKey | SAKGBZWJAIABSY-PJCXKLBTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | microglia (BTO:0000078) | MetaboLights (MTBLS1952) | Strain: ICR Mouse [NCIT:C37408] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 8-Iso-PGF3alpha (CHEBI:157746) is a prostanoid (CHEBI:26347) |
| IUPAC Name |
|---|
| (Z)-7-[(1S,2R,3R,5S)-3,5-dihydroxy-2-[(1E,3S,5Z)-3-hydroxyocta-1,5-dienyl]cyclopentyl]hept-5-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 4446338 | ChemSpider |
| LMFA03110007 | LIPID MAPS |
| HMDB0002132 | HMDB |