Metabolomics Structure Database

 
MW REGNO: 38
Common Name:Margaric acid
Systematic Name:heptadecanoic acid
Synonyms:Heptadecylic acid; C17:0 [PubChem Synonyms]
Exact Mass:
270.2559 (neutral)    Calculate m/z:
Formula:C17H34O2
InChIKey:KEMQGTRYUADPNZ-UHFFFAOYSA-N
LIPID MAPS Category:Fatty Acyls [LMFA]
LIPID MAPS mainclass:Fatty Acids and Conjugates [LMFA01]
LIPID MAPS subclass:Straight chain fatty acids [LMFA0101]
MoNA MS spectra:View spectra
Studies:Available studies

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External database links:

PubChem CID:10465
LIPID MAPS ID:LMFA01010017
CHEBI ID:32365
HMDB ID:HMDB0002259
Chemspider ID:10033
METLIN ID:6578
Natural Products Atlas ID:NP017017

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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