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CHEBI:58858 - N-(3-acetamidopropyl)-4-ammoniobutanal

ChEBI IDCHEBI:58858
ChEBI NameN-(3-acetamidopropyl)-4-ammoniobutanal
Stars
ASCII NameN-(3-acetamidopropyl)-4-ammoniobutanal
DefinitionConjugate acid of N-(3-acetamidopropyl)-4-aminobutanal arising from deprotonation of the secondary amino function.
Last Modified22 July 2015
DownloadsMolfile
FormulaC9H19N2O2
Net Charge+1
Average Mass187.263
Monoisotopic Mass187.14410
SMILES[H]C(=O)CCC[NH2+]CCCNC(C)=O
InChIInChI=1S/C9H18N2O2/c1-9(13)11-7-4-6-10-5-2-3-8-12/h8,10H,2-7H2,1H3,(H,11,13)/p+1
InChIKeyVYYITLJUFOHZTF-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
N-(3-acetamidopropyl)-4-ammoniobutanal (CHEBI:58858) is a ammonium ion derivative (CHEBI:35274)
N-(3-acetamidopropyl)-4-ammoniobutanal (CHEBI:58858) is conjugate acid of N-(3-acetamidopropyl)-4-aminobutanal (CHEBI:51051)
Incoming Relation(s)
N-(3-acetamidopropyl)-4-aminobutanal (CHEBI:51051) is conjugate base of N-(3-acetamidopropyl)-4-ammoniobutanal (CHEBI:58858)
IUPAC Name 
N-(3-acetamidopropyl)-4-oxobutan-1-aminium
Synonym  Source
(3-acetamidopropyl)(4-oxobutyl)azaniumChEBI
UniProt Name  Source
N-(3-acetamidopropyl)-4-aminobutanalUniProt