13,14-dihydro Prostaglandin F1α

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

ID: Reference9855

Other Names: 13,14-Dihydro PGF-1a;
13,14-Dihydro PGF-1α;
13,14-Dihydro prostaglandin F1α;
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-((S)-3-hydroxy-octyl)-cyclopentyl]-heptanoic acid;
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(3S)-3-hydroxyoctyl]cyclopentyl]heptanoic acid ; more

Formula: C20H38O5

Class: Endogenous Metabolites

Spectral Data

13,14-dihydro Prostaglandin F1α 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 Fusion with FAIMS
No. of Spectral Trees 1
No. of Spectra 1851
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/30/2020 7:25:37 AM
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Identificators

InChI InChI=1S/C20H38O5/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/h15-19,21-23H,2-14H2,1H3,(H,24,25)/t15-,16+,17+,18-,19+/m0/s1
InChI Key WMHAOJIJVNDMKA-BRIYLRKRSA-N
Canonical SMILES CCCCCC(CCC1C(CC(C1CCCCCCC(=O)O)O)O)O
CAS 20592205
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Other Names 13,14-Dihydro PGF-1a;
13,14-Dihydro PGF-1α;
13,14-Dihydro prostaglandin F1α;
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-((S)-3-hydroxy-octyl)-cyclopentyl]-heptanoic acid;
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(3S)-3-hydroxyoctyl]cyclopentyl]heptanoic acid;
7-[3,5-Dihydroxy-2-(3-hydroxy-octyl)-cyclopentyl]-heptanoic acid;
Prostan-1-oic acid, 9,11,15-trihydroxy-, (9α,11α,15S)-;
Prostan-1-oicacid, 9,11,15-trihydroxy-, (9a,11a,15S)-;
9α,11α,15S-trihydroxy-prostan-1-oic acid

In Other Databases

HMDb HMDB0005076
PubChem 5311239
ChemSpider 4470758
ChEMBL CHEMBL36817