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

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ChEBI Name 15-deoxy-delta12,14-Prostaglandin J2-2-glycerol ester
ChEBI ID CHEBI:172626
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C23H34O5
Net Charge 0
Average Mass 390.520
Monoisotopic Mass 390.24062
InChI InChI=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
InChIKey JGKIBUMNHSZUSL-WZOKZYBXSA-N
SMILES O=C1\C(\[C@@H](C/C=C\CCCC(OC(CO)CO)=O)C=C1)=C\C=C/CCCCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xrefs Databases
30776718 ChemSpider
HMDB0013656 HMDB
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