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prostaglandin E2(1−) (CHEBI:606564)

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ChEBI Name prostaglandin E2(1−)
ChEBI ID CHEBI:606564
ChEBI ASCII Name prostaglandin E2(1-)
Definition The conjugate base of prostaglandin E2; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
See structure as:  Image  Applet
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Formula Source
C20H31O5 ChEBI
Net Charge -1
Average Mass 351.45710
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)/p-1/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1
InChIKey
XEYBRNLFEZDVAW-ARSRFYASSA-M
SMILES
CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC([O-])=O
Metabolite of Species Source
Isolated from Homo sapiens (NCBI:9606) DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Application(s): oxytocic
A drug that stimulates contraction of the myometrium. Oxytocics are used to induce labour, obstetric at term, to prevent or control postpartum or postabortion haemorrhage, and to assess foetal status in high risk pregnancies. They may also be used alone or with other drugs to induce abortions (abortifacients).
View more on the ChEBI Ontology
ChEBI Ontology
Outgoing prostaglandin E2(1−) (CHEBI:606564) has role human metabolite (CHEBI:77746)
prostaglandin E2(1−) (CHEBI:606564) has role oxytocic (CHEBI:36063)
prostaglandin E2(1−) (CHEBI:606564) is a prostaglandin carboxylic acid anion (CHEBI:59326)
prostaglandin E2(1−) (CHEBI:606564) is conjugate base of prostaglandin E2 (CHEBI:15551)
Incoming prostaglandin E2 (CHEBI:15551) is conjugate acid of prostaglandin E2(1−) (CHEBI:606564)
IUPAC Name
(5Z,13E,15S)-11α,15-dihydroxy-9-oxoprosta-5,13-dien-1-oate
Synonyms Sources
prostaglandin E2 UniProt
prostaglandin E2 anion ChEBI
Registry Number Type Source
8364130 Beilstein Registry Number Beilstein
Last Modified
10 March 2014

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