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CHEBI:64335 - N1-aminopropylagmatine(3+)

ChEBI IDCHEBI:64335
ChEBI NameN1-aminopropylagmatine(3+)
Stars
ASCII NameN(1)-aminopropylagmatine(3+)
DefinitionA guanidinium ion obtained by protonation of the guanidino as well as the primary and secondary amino functions of N1-aminopropylagmatine; major species at pH 7.3.
Last Modified13 February 2024
SubmitterClaudia Rato da Silva
DownloadsMolfile
FormulaC8H24N5
Net Charge+3
Average Mass190.315
Monoisotopic Mass190.20153
SMILESNC(=[NH2+])NCCCC[NH2+]CCC[NH3+]
InChIInChI=1S/C8H21N5/c9-4-3-6-12-5-1-2-7-13-8(10)11/h12H,1-7,9H2,(H4,10,11,13)/p+3
InChIKeyXYCUJKFFVBCJEF-UHFFFAOYSA-Q
ChEBI Ontology
Outgoing Relation(s)
N1-aminopropylagmatine(3+) (CHEBI:64335) is a guanidinium ion (CHEBI:60251)
N1-aminopropylagmatine(3+) (CHEBI:64335) is conjugate acid of N1-aminoaminopropylagmatine (CHEBI:64339)
Incoming Relation(s)
N12-guanidothermospermine(+4) (CHEBI:230478) has functional parent N1-aminopropylagmatine(3+) (CHEBI:64335)
N1-aminoaminopropylagmatine (CHEBI:64339) is conjugate base of N1-aminopropylagmatine(3+) (CHEBI:64335)
IUPAC Name 
[azaniumyl({4-[(3-azaniumylpropyl)azaniumyl]butyl}amino)methylene]azaniumyl
Synonyms  Source
3-azaniumylpropyl-[4-(diaminomethylideneazaniumyl)butyl]azaniumSUBMITTER
[amino({4-[(3-ammoniopropyl)ammonio]butyl}amino)methylene]ammoniumIUPAC
N1-(3-aminoaminopropyl)agmatine(3+)ChEBI
UniProt Name  Source
N1-(3-aminopropyl)agmatineUniProt
Citations