EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:58869 - N-(3-ammoniopropyl)-4-ammoniobutanal

ChEBI IDCHEBI:58869
ChEBI NameN-(3-ammoniopropyl)-4-ammoniobutanal
Stars
ASCII NameN-(3-ammoniopropyl)-4-ammoniobutanal
DefinitionDication of N-(3-aminopropyl)-4-aminobutanal arising from protonation of both nitrogens.
Last Modified22 July 2015
DownloadsMolfile
FormulaC7H18N2O
Net Charge+2
Average Mass146.234
Monoisotopic Mass146.14082
SMILES[H]C(=O)CCC[NH2+]CCC[NH3+]
InChIInChI=1S/C7H16N2O/c8-4-3-6-9-5-1-2-7-10/h7,9H,1-6,8H2/p+2
InChIKeyJNZUMEMWAPJNLC-UHFFFAOYSA-P
ChEBI Ontology
Outgoing Relation(s)
N-(3-ammoniopropyl)-4-ammoniobutanal (CHEBI:58869) is a ammonium ion derivative (CHEBI:35274)
N-(3-ammoniopropyl)-4-ammoniobutanal (CHEBI:58869) is conjugate acid of N-(3-aminopropyl)-4-aminobutanal (CHEBI:51824)
Incoming Relation(s)
N-(3-aminopropyl)-4-aminobutanal (CHEBI:51824) is conjugate base of N-(3-ammoniopropyl)-4-ammoniobutanal (CHEBI:58869)
IUPAC Name 
N-(4-oxobutyl)propane-1,3-diaminium
Synonym  Source
(3-azaniumylpropyl)(4-oxobutyl)azaniumChEBI
UniProt Name  Source
N-(3-aminopropyl)-4-aminobutanalUniProt