15-Keto prostaglandin F1α

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Systematic / IUPAC Name: (9α,11α,13E)-9,11-Dihydroxy-15-oxoprost-13-en-1-oic acid

ID: Reference9817

Other Names: 15-Keto-PGF1α;
15k-PGF1a;
15-Oxo-PGF1α;
15-Oxoprostaglandin F1α;
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(E)-3-oxooct-1-enyl]cyclopentyl]heptanoic acid

Formula: C20H34O5

Class: Endogenous Metabolites

Spectral Data

15-Keto 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 2
No. of Spectra 5055
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/6/2020 2:38:01 PM
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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/h12-13,16-19,22-23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t16-,17-,18+,19-/m1/s1
InChI Key QPXXPLNAYDQELM-QNXXGYPUSA-N
Canonical SMILES CCCCCC(=O)C=CC1C(CC(C1CCCCCCC(=O)O)O)O
CAS 21562583
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Other Names 15-Keto-PGF1α;
15k-PGF1a;
15-Oxo-PGF1α;
15-Oxoprostaglandin F1α;
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(E)-3-oxooct-1-enyl]cyclopentyl]heptanoic acid;
9S,11R-Dihydroxy-15-oxo-13E-prostaenoic acid

In Other Databases

ChEBI CHEBI:72593
HMDb HMDB0060045
PubChem 5283118
ChemSpider 4446242