CHEBI:177392 - 13,14-Dihydro-15-keto Prostaglandin J2

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ChEBI Name 13,14-Dihydro-15-keto Prostaglandin J2
ChEBI ID CHEBI:177392
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30O4
Net Charge 0
Average Mass 334.456
Monoisotopic Mass 334.21441
InChI InChI=1S/C20H30O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h4,7,12,15-16,18H,2-3,5-6,8-11,13-14H2,1H3,(H,23,24)/b7-4-/t16-,18+/m0/s1
InChIKey GCYWVCQBMLYQGZ-BFVRRIQPSA-N
SMILES O=C1[C@@H]([C@@H](C/C=C\CCCC(O)=O)C=C1)CCC(=O)CCCCC
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in Sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing 13,14-Dihydro-15-keto Prostaglandin J2 (CHEBI:177392) is a prostanoid (CHEBI:26347)
IUPAC Name
(Z)-7-[(1S,5R)-4-oxo-5-(3-oxooctyl)cyclopent-2-en-1-yl]hept-5-enoic acid
Manual Xref Database
29341657 ChemSpider
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