Metabolomics Structure Database

MDLMOL SDF CSV TSV

MW REGNO:	4658
Common Name:	Dihomo-gamma-linolenoyl-EA
Systematic Name:	N-(8Z,11Z,14Z-eicosatrienoyl)-ethanolamine
RefMet Name:	Dihomo-gamma-linolenoyl-EA
Synonyms:	dihomo-gamma-linolenoylethanol amide [PubChem Synonyms]
Exact Mass:	349.2981 (neutral)    Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M-H+2K]+ [M+Na]+ [M+2Na]2+ [M-H+2Na]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M-H]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+HCOO]- M(neutral)
Formula:	C22H39NO2
InChIKey:	ULQWKETUACYZLI-QNEBEIHSSA-N
LIPID MAPS Category:	Fatty Acyls [FA]
LIPID MAPS mainclass:	Fatty amides [FA08]
LIPID MAPS subclass:	N-acyl ethanolamines (endocannabinoids) [FA0804]
SMILES:	CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)NCCO
Studies:	Available studies (via RefMet name)

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All Database Links Calculated Properties Human Pathways

External database links:

PubChem CID:	5282272
LIPID MAPS ID:	LMFA08040011
CHEBI ID:	34488
HMDB ID:	HMDB0013625
KEGG ID:	C13828
Chemspider ID:	4445443
Plant Metabolite Hub(Pmhub):	MS000016441

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