PGK1 (CHEBI:165340)

CHEBI:165340 - PGK1

Formula	C20H32O5
Net Charge	0
Average Mass	352.471
Monoisotopic Mass	352.22497
SMILES	CCCCC[C@H](O)/C=C/[C@H]1C(=O)CC(=O)[C@@H]1CCCCCCC(=O)O
InChI	InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,21H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+/m0/s1
InChIKey	KJWZYMMLVHIVSU-IYCNHOCDSA-N

ChEBI Ontology

Outgoing Relation(s)
	PGK1 (CHEBI:165340) is a prostanoid (CHEBI:26347)

IUPAC Name
7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-3,5-dioxocyclopentyl]heptanoic acid

Manual Xrefs	Databases
LMFA03010170	LIPID MAPS
17220785	ChemSpider