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CHEBI:15557 - 15-dehydro-prostaglandin D2

ChEBI IDCHEBI:15557
ChEBI Name15-dehydro-prostaglandin D2
Stars
ASCII Name15-dehydro-prostaglandin D2
DefinitionThe 15-dehydro derivative of prostaglandin D2.
Secondary ChEBI IDsCHEBI:249, CHEBI:10919, CHEBI:18592
Last Modified28 July 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC20H30O5
Net Charge0
Average Mass350.455
Monoisotopic Mass350.20932
SMILESCCCCCC(=O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O
InChIInChI=1S/C20H30O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,16-18,22H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t16-,17-,18+/m1/s1
InChIKeyXEQAHADLFLAPQL-RBIQQSKKSA-N
ChEBI Ontology
Outgoing Relation(s)
15-dehydro-prostaglandin D2 (CHEBI:15557) has functional parent prostaglandin D2 (CHEBI:15555)
15-dehydro-prostaglandin D2 (CHEBI:15557) is a prostaglandins D (CHEBI:26337)
15-dehydro-prostaglandin D2 (CHEBI:15557) is conjugate acid of 15-dehydro-prostaglandin D2(1−) (CHEBI:57408)
Incoming Relation(s)
15-dehydro-prostaglandin D2(1−) (CHEBI:57408) is conjugate base of 15-dehydro-prostaglandin D2 (CHEBI:15557)
IUPAC Name 
(5Z,13E)-9α-hydroxy-11,15-dioxoprosta-5,13-dienoic acid
Synonyms  Source
(5Z,13E)-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoateKEGG COMPOUND
15-deoxy-15-oxo-prostaglandin D2ChEBI
15-Dehydro-prostaglandin D2KEGG COMPOUND
Manual XrefsDatabases
C04758KEGG COMPOUND