Metabolomics Structure Database

 
Created with Raphaƫl 2.1.0NHOOOH
MW REGNO: 203059
Common Name:NA-PABA 11:0
Systematic Name:N-(undecanoyl)-4-aminobenzoic acid
RefMet Name:NA-PABA 11:0
Synonyms: [PubChem Synonyms]
Exact Mass:
305.1991 (neutral)    Calculate m/z:
Formula:C18H27NO3
InChIKey:UZFHTFPZGVMZAY-UHFFFAOYSA-N
LIPID MAPS Category:Fatty Acyls [FA]
LIPID MAPS mainclass:Fatty amides [FA08]
LIPID MAPS subclass:N-acyl amines [FA0802]
SMILES:CCCCCCCCCCC(=O)Nc1ccc(cc1)C(=O)O
Studies:Available studies (via RefMet name)

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External database links:

PubChem CID:152093470

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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