Prostaglandin E2

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Systematic / IUPAC Name: (5Z,11α,13E,15S)-11,15-Dihydroxy-9-oxoprosta-5,13-dien-1-oic acid

ID: Reference1357

Other Names: Prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, (5Z,11α,13E,15S)-;
5-Heptenoic acid, 7-(3-hydroxy-2-(3-hydroxy-1-octenyl)-5-oxocyclopentyl)-, L-;
L-7-(3-Hydroxy-2-(3-hydroxy-1-octenyl)-5-oxocyclopentyl)-5-heptenoic acid;
(5Z,13E)-(15S)-11α,15-Dihydroxy-9-oxoprost-13-enoate;
Prosta-5,13-dien-1-oic acid, (5Z,11-α,13E,15S)-11,15-dihydroxy-9-oxo- ; more

Formula: C20H32O5

Class: Endogenous Metabolites Therapeutics/Prescription Drugs

Spectral Data

Prostaglandin E2 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Orbitrap Fusion with FAIMS
No. of Spectral Trees 3
No. of Spectra 3611
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 8/18/2020 9:12:35 AM
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Identificators

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
InChI Key XEYBRNLFEZDVAW-ARSRFYASSA-N
Canonical SMILES CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O
CAS 363246
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Other Names Prosta-5,13-dien-1-oic acid, 11,15-dihydroxy-9-oxo-, (5Z,11α,13E,15S)-;
5-Heptenoic acid, 7-(3-hydroxy-2-(3-hydroxy-1-octenyl)-5-oxocyclopentyl)-, L-;
L-7-(3-Hydroxy-2-(3-hydroxy-1-octenyl)-5-oxocyclopentyl)-5-heptenoic acid;
(5Z,13E)-(15S)-11α,15-Dihydroxy-9-oxoprost-13-enoate;
Prosta-5,13-dien-1-oic acid, (5Z,11-α,13E,15S)-11,15-dihydroxy-9-oxo-;
(5Z,13E,15S)-11α,15-Dihydroxy-9-oxoprosta-5,13-dien-1-oic acid;
9-Oxo-11R,15S-dihydroxy-5Z,13E-prostadienoic acid;
(Z)-7-((1R,2R,3R)-3-Hydroxy-2-((S,E)-3-hydroxyoct-1-en-1-yl)-5-oxocyclopentyl)hept-5-enoic acid;
Dinoprostone;
Pge2;
Prostin E2;
Prepidil;
Cervidil;
Propess;
Prostin;
Prostarmon E;
Minprostin E2;
L-Prostaglandin E2;
Minprositin E2;
Prostaglandin E2α

In Other Databases

ChemSpider 4444059
KEGG C00584; D00079
Wikipedia Prostaglandin E2
HMDb HMDB01220
ChEMBL CHEMBL548
ChemIDPlus 000363246; 053697179
PubChem 5280360
LipidsMAPs LMFA03010003
ChEBI CHEBI:15551