Metabolomics Structure Database

 
MW REGNO: 3588
Common Name:14-Methyl-8E-hexadecenal
Systematic Name:14-Methyl-8E-hexadecenal
Synonyms: [PubChem Synonyms]
Exact Mass:
252.2453 (neutral)    Calculate m/z:
Formula:C17H32O
InChIKey:HSGUJTMCFWXGAP-FNORWQNLSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Fatty aldehydes [FA06]
SMILES:CCC(C)CCCC/C=C/CCCCCCC=O
Studies:Available studies(via PubChem CID)

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External database links:

PubChem CID:6073809
LIPID MAPS ID:LMFA06000194

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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