Metabolomics Structure Database

 
MW REGNO: 63043
Common Name:19-hydroxyprostaglandin H2
Systematic Name:(5Z)-7-{(1R,4S,5R,6R)-6-[(1E,3S)-3,7-dihydroxyoct-1-en-1-yl]-2,3-dioxabicyclo[2.2.1]hept-5-yl}hept-5-enoic acid
Synonyms:(5Z,13E,15S)-9alpha,11alpha-epidioxy-15,19-dihydroxyprosta-5,13-dienoic acid [PubChem Synonyms]
Exact Mass:
368.2199 (neutral)    Calculate m/z:
Formula:C20H32O6
InChIKey:MTVPUJQVDLAVML-AHYYGCRPSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Eicosanoids [FA03]
LIPID MAPS subclass:Prostaglandins [FA0301]
SMILES:CC(CCC[C@@H](/C=C/[C@@H]1[C@@H](C/C=CCCCC(=O)O)[C@@H]2C[C@H]1OO2)O)O
Studies:-

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Human Pathway links:

REACTOME pathways containing this metabolite

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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