13,14-Dihydro prostaglandin E1

enlarge

Systematic / IUPAC Name: (11α,15S)-11,15-Dihydroxy-9-oxoprostan-1-oic acid

ID: Reference9754

Other Names: (15S)-Dihydroprostaglandin E1;
13,14-Dihydro-pge1;
Dihydro-pge1;
Dihydroprostaglandin E1;
Pge0 ; more

Formula: C20H36O5

Class: Endogenous Metabolites

Spectral Data

13,14-Dihydro 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 Fusion with FAIMS
No. of Spectral Trees 2
No. of Spectra 690
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/12/2020 7:11:36 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C20H36O5/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/h15-17,19,21,23H,2-14H2,1H3,(H,24,25)/t15-,16+,17+,19+/m0/s1
InChI Key DPOINJQWXDTOSF-DODZYUBVSA-N
Canonical SMILES CCCCCC(CCC1C(CC(=O)C1CCCCCCC(=O)O)O)O
CAS 19313281
Splash
Other Names (15S)-Dihydroprostaglandin E1;
13,14-Dihydro-pge1;
Dihydro-pge1;
Dihydroprostaglandin E1;
Pge0;
Pge1, 13,14-dihydro;
Prostaglandin E0;
11,15-Dihydroxy-9-ketoprostanoate;
11,15-Dihydroxy-9-ketoprostanoic acid;
11a,15-Dihydroxy-9-oxoprostanoate;
11a,15-Dihydroxy-9-oxoprostanoic acid;
3-Hydroxy-2-(3-hydroxyoctyl)-5-oxo-cyclopentaneheptanoate;
3-Hydroxy-2-(3-hydroxyoctyl)-5-oxo-cyclopentaneheptanoic acid;
7-[(1R,2R,3R)-3-Hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentyl]heptanoic acid;
9-Oxo-11R,15S-dihydroxy-prostanoic acid;
Prostan-1-oic acid, 11,15-dihydroxy-9-oxo-, (11α,15S)-;
Prostan-1-oic acid,11,15-dihydroxy-9-oxo-, (11a,15S)-

In Other Databases

PubChem 161273
ChEBI CHEBI:89310
HMDb HMDB0002689
ChEMBL CHEMBL1476810
ChemIDPlus 019313281
ChemSpider 141668