Metabolomics Structure Database

 
MW REGNO: 37687
Common Name:Spermidine
Systematic Name:(4-aminobutyl)(3-aminopropyl)amine
RefMet Name:Spermidine
Synonyms: [PubChem Synonyms]
Exact Mass:
145.1579 (neutral)    Calculate m/z:
Formula:C7H19N3
InChIKey:ATHGHQPFGPMSJY-UHFFFAOYSA-N
ClassyFire superclass:Organic nitrogen compounds
ClassyFire class:Organonitrogen compounds
ClassyFire subclass:Amines
ClassyFire direct parent:Dialkylamines
Massbank MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:C(CCNCCCN)CN
Studies:Available studies (via RefMet name)

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Human Pathway links:

HMDB and KEGG pathways containing this metabolite

REACTOME pathways containing this metabolite

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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