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CHEBI:136653 - 20-hydroxyprostaglandin E2(1−)

ChEBI IDCHEBI:136653
ChEBI Name20-hydroxyprostaglandin E2(1−)
Stars
ASCII Name20-hydroxyprostaglandin E2(1-)
DefinitionA prostaglandin carboxylic acid anion that is the conjugate base of 20-hydroxyprostaglandin E2, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified8 June 2017
Submitterlaimo
DownloadsMolfile
FormulaC20H31O6
Net Charge-1
Average Mass367.462
Monoisotopic Mass367.21261
SMILESO=C([O-])CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCCCCO
InChIInChI=1S/C20H32O6/c21-13-7-3-4-8-15(22)11-12-17-16(18(23)14-19(17)24)9-5-1-2-6-10-20(25)26/h1,5,11-12,15-17,19,21-22,24H,2-4,6-10,13-14H2,(H,25,26)/p-1/b5-1-,12-11+/t15-,16+,17+,19+/m0/s1
InChIKeyAZIGEYVZEVXWAD-NZGURKHLSA-M
ChEBI Ontology
Outgoing Relation(s)
20-hydroxyprostaglandin E2(1−) (CHEBI:136653) has functional parent prostaglandin E2(1−) (CHEBI:606564)
20-hydroxyprostaglandin E2(1−) (CHEBI:136653) is a prostaglandin carboxylic acid anion (CHEBI:59326)
20-hydroxyprostaglandin E2(1−) (CHEBI:136653) is conjugate base of 20-hydroxyprostaglandin E2 (CHEBI:137370)
Incoming Relation(s)
20-hydroxyprostaglandin E2 (CHEBI:137370) is conjugate acid of 20-hydroxyprostaglandin E2(1−) (CHEBI:136653)
IUPAC Name 
(5Z,13E,15S)-11α,15,20-trihydroxy-9-oxoprosta-5,13-dien-1-oate
Synonyms  Source
20-hydroxy-prostaglandin E2(1−)ChEBI
20-hydroxy-PGE2(1−)ChEBI
(5Z,11α,13E,15S)-11,15,20-trihydroxy-9-oxoprosta-5,13-dien-1-oateIUPAC
UniProt Name  Source
20-hydroxy prostaglandin E2UniProt
Citations