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 350.20932
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
Manual Xrefs Databases
C04707 KEGG COMPOUND
FDB023119 FooDB
HMDB0003175 HMDB
LMFA03010030 LIPID MAPS
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Registry Number Type Source
26441-05-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
23542179 PubMed citation Europe PMC
23687300 PubMed citation Europe PMC
26590294 PubMed citation Europe PMC
26820738 PubMed citation Europe PMC
30921435 PubMed citation Europe PMC
33147298 PubMed citation Europe PMC
33681993 PubMed citation Europe PMC
37538064 PubMed citation Europe PMC
Last Modified
28 May 2024