Metabolomics Structure Database

 
MW REGNO: 38003
Common Name:N-Acetylputrescine
Systematic Name:N-(4-aminobutyl)acetamide
Synonyms: [PubChem Synonyms]
Exact Mass:
130.1106 (neutral)    Calculate m/z:
Formula:C6H14N2O
InChIKey:KLZGKIDSEJWEDW-UHFFFAOYSA-N
ClassyFire superclass:Organic acids and derivatives [C0000264]
ClassyFire class:Carboxylic acids and derivatives [C0000265]
ClassyFire subclass:Carboxylic acid derivatives [C0001093]
ClassyFire direct parent:Acetamides [C0003922]
MoNA MS spectra:View spectra
Studies:Available studies

Select appropriate tab below to view additional details:

External database links:

PubChem CID:122356
CHEBI ID:17768
HMDB ID:HMDB0002064
KEGG ID:C02714
Chemspider ID:109095
METLIN ID:3252
MetaCyc ID:CPD-569
EPA CompTox DB:DTXCID10128087

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

  logo