CHEBI:175746 - 5(6)-Epoxy Prostaglandin E1

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5(6)-Epoxy Prostaglandin E1
ChEBI ID CHEBI:175746
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H32O6
Net Charge 0
Average Mass 368.470
Monoisotopic Mass 368.21989
InChI InChI=1S/C20H32O6/c1-2-3-4-6-13(21)9-10-14-15(17(23)12-16(14)22)11-19-18(26-19)7-5-8-20(24)25/h9-10,13-16,18-19,21-22H,2-8,11-12H2,1H3,(H,24,25)/b10-9+/t13-,14-,15-,16-,18?,19?/m0/s1
InChIKey CBOBGOJUDRNUHE-HHECASJMSA-N
SMILES O1C(C1CCCC(O)=O)C[C@H]2[C@@H]([C@@H](O)CC2=O)/C=C/[C@@H](O)CCCCC
ChEBI Ontology
Outgoing 5(6)-Epoxy Prostaglandin E1 (CHEBI:175746) is a prostanoid (CHEBI:26347)
IUPAC Name
4-[3-[[(1S,2S,3S)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]methyl]oxiran-2-yl]butanoic acid
Manual Xrefs Databases
35032400 ChemSpider
HMDB0012110 HMDB
LMFA03020068 LIPID MAPS
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