Prostaglandin E1

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Systematic / IUPAC Name: 7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid

ID: Reference1356

Other Names: 11α,15α-Dihydroxy-9-oxo-13-trans-prostenoic acid;
(11α,13E,15S)-11,15-Dihydroxy-9-oxoprost-13-enoic acid;
Prost-13-en-1-oic acid, 11,15-dihydroxy-9-oxo-, (11α,13E,15S)-;
11,15-Dihydroxy-9-oxoprost-13-en-1-oic acid;
3-Hydroxy-2-(3-hydroxy-1-octenyl)-5-oxo-cyclopentaneheptanoic acid ; more

Formula: C20H34O5

Class: Endogenous Metabolites Therapeutics/Prescription Drugs

Spectral Data

Prostaglandin E1 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite; Orbitrap Fusion with FAIMS
No. of Spectral Trees 3
No. of Spectra 3695
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 8/18/2020 9:27:08 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C20H34O5/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/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,19+/m0/s1
InChI Key GMVPRGQOIOIIMI-DWKJAMRDSA-N
Canonical SMILES CCCCCC(C=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O
CAS 745653
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Other Names 11α,15α-Dihydroxy-9-oxo-13-trans-prostenoic acid;
(11α,13E,15S)-11,15-Dihydroxy-9-oxoprost-13-enoic acid;
Prost-13-en-1-oic acid, 11,15-dihydroxy-9-oxo-, (11α,13E,15S)-;
11,15-Dihydroxy-9-oxoprost-13-en-1-oic acid;
3-Hydroxy-2-(3-hydroxy-1-octenyl)-5-oxo-cyclopentaneheptanoic acid;
(1R,2R,3R)-3-Hydroxy-2-((E)-(3S)-3-hydroxy-1-octenyl)-5-oxocyclopentaneheptanoic acid;
9-Oxo-11R,15S-dihydroxy-13E-prostaenoic acid;
(13E)-(15S)-11,15-Dihydroxy-9-oxoprost-13-enoate;
(13E)-(15S)-11α,15-Dihydroxy-9-oxoprost-13-enoic acid;
Edex;
Muse;
Prostin VR;
Befar;
Femprox;
Sugiran;
Viridal;
Prostavasin;
Topiglan;
Alprox-TD;
Prostandin;
Minprog;
Alista;
Prink;
Lipoprost;
Liprostin;
Prostivas

In Other Databases

ChemSpider 4444306
PubChem 5280723
ChEBI CHEBI:15544
ChEMBL CHEMBL495
KEGG C04741; C13548; D00180; D02705
ChemIDPlus 119314691
Wikipedia Prostaglandin E1
HMDb HMDB01442
LipidsMAPs LMFA03010134