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CHEBI:137370 - 20-hydroxyprostaglandin E2

ChEBI IDCHEBI:137370
ChEBI Name20-hydroxyprostaglandin E2
Stars
ASCII Name20-hydroxyprostaglandin E2
DefinitionA prostaglandin E derivative that is prostaglandin E2 in which one of the methyl hydrogens at position 20 has been replaced by a hydroxy group.
Last Modified26 June 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H32O6
Net Charge0
Average Mass368.470
Monoisotopic Mass368.21989
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)/b5-1-,12-11+/t15-,16+,17+,19+/m0/s1
InChIKeyAZIGEYVZEVXWAD-NZGURKHLSA-N
ChEBI Ontology
Outgoing Relation(s)
20-hydroxyprostaglandin E2 (CHEBI:137370) has functional parent prostaglandin E2 (CHEBI:15551)
20-hydroxyprostaglandin E2 (CHEBI:137370) is a primary alcohol (CHEBI:15734)
20-hydroxyprostaglandin E2 (CHEBI:137370) is a prostaglandins E (CHEBI:26338)
20-hydroxyprostaglandin E2 (CHEBI:137370) is a secondary allylic alcohol (CHEBI:134396)
20-hydroxyprostaglandin E2 (CHEBI:137370) is a triol (CHEBI:27136)
20-hydroxyprostaglandin E2 (CHEBI:137370) is conjugate acid of 20-hydroxyprostaglandin E2(1−) (CHEBI:136653)
Incoming Relation(s)
20-hydroxyprostaglandin E2(1−) (CHEBI:136653) is conjugate base of 20-hydroxyprostaglandin E2 (CHEBI:137370)
IUPAC Name 
(5Z,13E,15S)-11α,15,20-trihydroxy-9-oxoprosta-5,13-dien-1-oic acid
Synonyms  Source
20-hydroxy prostaglandin E2ChEBI
20-hydroxy-PGE2ChEBI
20-hydroxy-prostaglandin E2ChEBI
9-oxo-11R,15S,20-trihydroxy-5Z,13E-prostadienoic acidLIPID MAPS
20-OH-PGE2ChEBI
(5Z,11α,13E,15S)-11,15,20-trihydroxy-9-oxoprosta-5,13-dien-1-oic acidIUPAC
Manual XrefsDatabases
LMFA03010014LIPID MAPS
HMDB0003247HMDB
Registry NumbersSources
Reaxys:2951905Reaxys
CAS:57930-95-7ChemIDplus
Citations