CHEBI:28269 - 6-oxoprostaglandin E1

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-oxoprostaglandin E1
ChEBI ID CHEBI:28269
ChEBI ASCII Name 6-oxoprostaglandin E1
Definition A prostaglandin E that is prostaglandin E1 bearing a keto substituent at the 6-position.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:2204, CHEBI:20735
Supplier Information ZINC000004632133
Download Molfile XML SDF
Formula C20H32O6
Net Charge 0
Average Mass 368.46448
Monoisotopic Mass 368.21989
InChI InChI=1S/C20H32O6/c1-2-3-4-7-14(21)10-11-16-17(19(24)13-18(16)23)12-15(22)8-5-6-9-20(25)26/h10-11,14,16-18,21,23H,2-9,12-13H2,1H3,(H,25,26)/b11-10+/t14-,16+,17+,18+/m0/s1
InChIKey ROUDCKODIMKLNO-CTBSXBMHSA-N
SMILES CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1CC(=O)CCCCC(O)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): platelet aggregation inhibitor
A drug or agent which antagonizes or impairs any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 6-oxoprostaglandin E1 (CHEBI:28269) has functional parent prostaglandin E1 (CHEBI:15544)
6-oxoprostaglandin E1 (CHEBI:28269) has role metabolite (CHEBI:25212)
6-oxoprostaglandin E1 (CHEBI:28269) has role platelet aggregation inhibitor (CHEBI:50427)
6-oxoprostaglandin E1 (CHEBI:28269) is a prostaglandins E (CHEBI:26338)
6-oxoprostaglandin E1 (CHEBI:28269) is conjugate acid of 6-oxoprostaglandin E1(1−) (CHEBI:134577)
Incoming 6-oxoprostaglandin E1(1−) (CHEBI:134577) is conjugate base of 6-oxoprostaglandin E1 (CHEBI:28269)
IUPAC Name
(13E,15S)-11α,15-dihydroxy-6,9-dioxoprost-13-en-1-oic acid
Synonyms Sources
6-Keto-PGE1 KEGG COMPOUND
6-Keto-prostaglandin E1 KEGG COMPOUND
6-Ketoprostaglandin E1 ChemIDplus
6-Oxo-PGE1 ChemIDplus
6-Oxoprostaglandin E1 ChemIDplus
Manual Xrefs Databases
C05962 KEGG COMPOUND
LMFA03010012 LIPID MAPS
View more database links
Registry Numbers Types Sources
2904839 Reaxys Registry Number Reaxys
67786-53-2 CAS Registry Number ChemIDplus
Citations Types Sources
2858551 PubMed citation Europe PMC
3240016 PubMed citation Europe PMC
3881101 PubMed citation Europe PMC
6132981 PubMed citation Europe PMC
6360281 PubMed citation Europe PMC
Last Modified
09 May 2017