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CHEBI:172626 - 15-deoxy-delta12,14-Prostaglandin J2-2-glycerol ester

ChEBI IDCHEBI:172626
ChEBI Name15-deoxy-delta12,14-Prostaglandin J2-2-glycerol ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H34O5
Net Charge0
Average Mass390.520
Monoisotopic Mass390.24062
SMILESCCCCC/C=C\C=C1\C(=O)C=C[C@@H]1C/C=C\CCCC(=O)OC(CO)CO
InChIInChI=1S/C23H34O5/c1-2-3-4-5-6-10-13-21-19(15-16-22(21)26)12-9-7-8-11-14-23(27)28-20(17-24)18-25/h6-7,9-10,13,15-16,19-20,24-25H,2-5,8,11-12,14,17-18H2,1H3/b9-7-,10-6-,21-13+/t19-/m0/s1
InChIKeyJGKIBUMNHSZUSL-WZOKZYBXSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
15-deoxy-delta12,14-Prostaglandin J2-2-glycerol ester (CHEBI:172626) is a prostanoid (CHEBI:26347)
IUPAC Name 
1,3-dihydroxypropan-2-yl (Z)-7-[(1S,5E)-5-[(Z)-oct-2-enylidene]-4-oxocyclopent-2-en-1-yl]hept-5-enoate
Manual XrefsDatabases
30776718ChemSpider
HMDB0013656HMDB