CHEBI:89581 - 11b-PGE2

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 11b-PGE2
ChEBI ID CHEBI:89581
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H32O5
Net Charge 0
Average Mass 352.466
Monoisotopic Mass 352.225
InChI InChI=1S/C20H32O5/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/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19-/m0/s1
InChIKey XEYBRNLFEZDVAW-YUOXZBOXSA-N
SMILES O=C1[C@H](C/C=C\CCCC(O)=O)[C@@H](/C=C/[C@@H](O)CCCCC)[C@@H](O)C1
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed
ChEBI Ontology
Outgoing 11b-PGE2 (CHEBI:89581) is a prostanoid (CHEBI:26347)
IUPAC Name
(5Z)-7-[(1R,2R,3S)-3-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-5-oxocyclopentyl]hept-5-enoic acid
Synonyms Sources
(5Z,11beta,13E,15S)-11,15-Dihydroxy-9-oxoprosta-5,13-dien-1-oic acid HMDB
(Z)-7-[(1R,2R,3S)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid HMDB
Manual Xref Database
HMDB0060041 HMDB
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Citations Waiting for Citations Types Sources
20671299 PubMed citation Europe PMC
21317107 PubMed citation Europe PMC