Metabolomics Structure Database

 
MW REGNO: 2586
Common Name:14,15-LTD4
Systematic Name:15S-hydroxy,14R-(S-cysteinylglycinyl)-5Z,8Z,10E,12E-eicosatetraenoic acid
RefMet Name:14,15-LTD4
Synonyms:14,15-Leukotriene D4; EXD4 [PubChem Synonyms]
Exact Mass:
496.2607 (neutral)    Calculate m/z:
Formula:C25H40N2O6S
InChIKey:BUTLPEVGZIRJOA-SPCGXPCUSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Eicosanoids [FA03]
LIPID MAPS subclass:Leukotrienes [FA0302]
SMILES:CCCCC[C@@H]([C@@H](/C=C/C=C/C=CC/C=CCCCC(=O)O)SC[C@@H](C(=O)NCC(=O)O)N)O
Studies:Available studies (via RefMet name)

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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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