13,14-dihydro-15-keto-tetranor Prostaglandin E2 (CHEBI:192587)

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CHEBI:192587 - 13,14-dihydro-15-keto-tetranor Prostaglandin E2

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ChEBI ID	CHEBI:192587
ChEBI Name	13,14-dihydro-15-keto-tetranor Prostaglandin E2
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H26O5
Net Charge	0
Average Mass	298.379
Monoisotopic Mass	298.17802
SMILES	CCCCCC(=O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1CCC(=O)O
InChI	InChI=1S/C16H26O5/c1-2-3-4-5-11(17)6-7-12-13(8-9-16(20)21)15(19)10-14(12)18/h12-14,18H,2-10H2,1H3,(H,20,21)/t12-,13-,14-/m1/s1
InChIKey	FGACPXKRXBKDQL-MGPQQGTHSA-N

Species of Metabolite	Component	Source	Comments
Valsa sordida (ncbitaxon:252740)	Whole Organism (NCIT:C13413)	MetaboLights (MTBLS4463)

ChEBI Ontology

Outgoing Relation(s)
	13,14-dihydro-15-keto-tetranor Prostaglandin E2 (CHEBI:192587) is a cyclopentanols (CHEBI:23495)

IUPAC Name
3-[(1R,2R,3R)-3-hydroxy-5-oxo-2-(3-oxooctyl)cyclopentyl]propanoic acid

Manual Xrefs	Databases
29341954	ChemSpider