Metabolomics Structure Database

 
MW REGNO: 2434
Common Name:PGF2alpha methyl ether
Systematic Name:1-methoxy-9S,11R,15S-trihydroxy-5Z,13E-prostadiene
RefMet Name:PGF2alpha methyl ether
Synonyms:Prostaglandin F2alpha methyl ether [PubChem Synonyms]
Exact Mass:
354.2770 (neutral)    Calculate m/z:
Formula:C21H38O4
InChIKey:VWEVSUSNDAHANL-GPPPFWBLSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Eicosanoids [FA03]
LIPID MAPS subclass:Prostaglandins [FA0301]
SMILES:CCCCC[C@@H](O)/C=C/[C@H]1[C@H](C/C=C\CCCCOC)[C@H](O)C[C@@H]1O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:5283074
LIPID MAPS ID:LMFA03010073
CHEBI ID:137215

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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