CHEBI:15547 - 15-dehydro-prostaglandin E2

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 15-dehydro-prostaglandin E2
ChEBI ID CHEBI:15547
ChEBI ASCII Name 15-dehydro-prostaglandin E2
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:247, CHEBI:10917, CHEBI:10908, CHEBI:18588, CHEBI:243, CHEBI:33096
Supplier Information
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Formula C20H30O5
Net Charge 0
Average Mass 350.44920
Monoisotopic Mass 350.209
InChI InChI=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/h4,7,12-13,16-17,19,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t16-,17-,19-/m1/s1
InChIKey YRTJDWROBKPZNV-KMXMBPPJSA-N
SMILES CCCCCC(=O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(O)=O
ChEBI Ontology
Outgoing 15-dehydro-prostaglandin E2 (CHEBI:15547) has functional parent prostaglandin E2 (CHEBI:15551)
15-dehydro-prostaglandin E2 (CHEBI:15547) is a prostaglandins E (CHEBI:26338)
15-dehydro-prostaglandin E2 (CHEBI:15547) is conjugate acid of 15-dehydro-prostaglandin E2(1−) (CHEBI:57400)
Incoming 15-dehydro-prostaglandin E2(1−) (CHEBI:57400) is conjugate base of 15-dehydro-prostaglandin E2 (CHEBI:15547)
IUPAC Name
(5Z,13E)-11α-hydroxy-9,15-dioxoprosta-5,13-dienoic acid
Synonyms Sources
(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprosta-13-enoate KEGG COMPOUND
(5Z)-(15S)-11alpha-Hydroxy-9,15-dioxoprosta-13-enoate KEGG COMPOUND
(5Z,13E)-11alpha-Hydroxy-9,15-dioxoprost-13-enoate KEGG COMPOUND
15-deoxy-15-oxo-prostaglandin E2 ChEBI
15-Keto-PGE2 LIPID MAPS
15-Keto-prostaglandin E2 ChemIDplus
15-Ketoprostaglandin E2 ChemIDplus
15-Oxo-PGE2 ChemIDplus
Database Links Databases
C04707 KEGG COMPOUND
C04743 KEGG COMPOUND
LMFA03010030 LIPID MAPS
View more database links
Registry Number Type Source
26441-05-4 CAS Registry Number ChemIDplus
Last Modified
23 October 2015