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CHEBI:183965 - 11-deoxy-16,16-dimethylprostaglandin e2
| Formula | C22H36O4 |
| Net Charge | 0 |
| Average Mass | 364.526 |
| Monoisotopic Mass | 364.26136 |
| SMILES | CCCCC(C)(C)C(O)/C=C/[C@H]1CCC(=O)C1C/C=C\CCCC(=O)O |
| InChI | InChI=1S/C22H36O4/c1-4-5-16-22(2,3)20(24)15-13-17-12-14-19(23)18(17)10-8-6-7-9-11-21(25)26/h6,8,13,15,17-18,20,24H,4-5,7,9-12,14,16H2,1-3H3,(H,25,26)/b8-6-,15-13+/t17-,18?,20?/m1/s1 |
| InChIKey | LLVVDFDWPQHXBA-PMOPTMIRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Nippostrongylus brasiliensis (ncbitaxon:27835) | Whole Organism (NCIT:C13413) | MetaboLights (MTBLS3486) | |
| Mus musculus (ncbitaxon:10090) | small intestine (BTO:0000651) | MetaboLights (MTBLS3486) | Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 11-deoxy-16,16-dimethylprostaglandin e2 (CHEBI:183965) is a prostanoid (CHEBI:26347) |
| IUPAC Name |
|---|
| (Z)-7-[(2R)-2-[(E)-3-hydroxy-4,4-dimethyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 21467033 | ChemSpider |