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CHEBI:134577 - 6-oxoprostaglandin E1(1−)

Default Structure
ChEBI IDCHEBI:134577
ChEBI Name6-oxoprostaglandin E1(1−)
Stars
ASCII Name6-oxoprostaglandin E1(1-)
DefinitionA prostaglandin carboxylic acid anion that is the conjugate base of 6-oxoprostaglandin E1, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified9 May 2017
Submitterlaimo
DownloadsMolfile
FormulaC20H31O6
Net Charge-1
Average Mass367.462
Monoisotopic Mass367.21261
SMILESCCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CC(=O)CCCCC(=O)[O-]
InChIInChI=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)/p-1/b11-10+/t14-,16+,17+,18+/m0/s1
InChIKeyROUDCKODIMKLNO-CTBSXBMHSA-M
ChEBI Ontology
Outgoing Relation(s)
6-oxoprostaglandin E1(1−) (CHEBI:134577) is a prostaglandin carboxylic acid anion (CHEBI:59326)
6-oxoprostaglandin E1(1−) (CHEBI:134577) is conjugate base of 6-oxoprostaglandin E1 (CHEBI:28269)
Incoming Relation(s)
6-oxoprostaglandin E1 (CHEBI:28269) is conjugate acid of 6-oxoprostaglandin E1(1−) (CHEBI:134577)
IUPAC Name 
(13E,15S)-11α,15-dihydroxy-6,9-dioxoprost-13-en-1-oate
Synonym  Source
6-keto-prostaglandin E1(1−)ChEBI
UniProt Name  Source
6-oxo-prostaglandin E1UniProt