CHEBI:58101 - N1-acetylsperminium(3+)

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ChEBI Name N1-acetylsperminium(3+)
ChEBI ID CHEBI:58101
ChEBI ASCII Name N(1)-acetylsperminium(3+)
Definition Trication of N1-acetylspermine arising from protonation of the one primary and two secondary amino groups; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H31N4O
Net Charge +3
Average Mass 247.40070
Monoisotopic Mass 247.24814
InChI InChI=1S/C12H28N4O/c1-12(17)16-11-5-10-15-8-3-2-7-14-9-4-6-13/h14-15H,2-11,13H2,1H3,(H,16,17)/p+3
InChIKey GUNURVWAJRRUAV-UHFFFAOYSA-Q
SMILES CC(=O)NCCC[NH2+]CCCC[NH2+]CCC[NH3+]
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N1-acetylsperminium(3+) (CHEBI:58101) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
N1-acetylsperminium(3+) (CHEBI:58101) has role human metabolite (CHEBI:77746)
N1-acetylsperminium(3+) (CHEBI:58101) is a ammonium ion derivative (CHEBI:35274)
N1-acetylsperminium(3+) (CHEBI:58101) is a organic cation (CHEBI:25697)
N1-acetylsperminium(3+) (CHEBI:58101) is conjugate acid of N1-acetylspermine (CHEBI:17312)
Incoming N1-acetylspermine (CHEBI:17312) is conjugate base of N1-acetylsperminium(3+) (CHEBI:58101)
IUPAC Name
N-(3-acetamidopropyl)-N'-(3-azaniumylpropyl)butane-1,4-diaminium
Synonyms Sources
N1-acetylspermine UniProt
N1-acetylsperminium trication ChEBI
Manual Xref Database
N1-ACETYLSPERMINE MetaCyc
View more database links
Last Modified
21 January 2016