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CHEBI:192604 - 11-Epiprostaglandin E1

ChEBI IDCHEBI:192604
ChEBI Name11-Epiprostaglandin E1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H34O5
Net Charge0
Average Mass354.487
Monoisotopic Mass354.24062
SMILESCCCCC[C@H](O)/C=C/[C@H]1[C@@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O
InChIInChI=1S/C20H34O5/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/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,19-/m0/s1
InChIKeyGMVPRGQOIOIIMI-FZYGRIMQSA-N
Species of MetaboliteComponentSourceComments
Valsa sordida (ncbitaxon:252740) Whole Organism (NCIT:C13413) MetaboLights (MTBLS4463)
ChEBI Ontology
Outgoing Relation(s)
11-Epiprostaglandin E1 (CHEBI:192604) is a prostanoid (CHEBI:26347)
IUPAC Name 
7-[(1R,2R,3S)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid
Manual XrefsDatabases
LMFA03010106LIPID MAPS
4446224ChemSpider
Registry NumbersSources
CAS:24570-01-2ChemIDplus