CHEBI:17906 - aminoacetone

ChEBI IDCHEBI:17906
ChEBI Nameaminoacetone
Stars
DefinitionA propanone consisting of acetone having an amino group at the 1-position.
Secondary ChEBI IDsCHEBI:2648, CHEBI:13767, CHEBI:19025, CHEBI:42749, CHEBI:42849
Last Modified20 November 2019
DownloadsMolfile
FormulaC3H7NO
Net Charge0
Average Mass73.095
Monoisotopic Mass73.05276
SMILESCC(=O)CN
InChIInChI=1S/C3H7NO/c1-3(5)2-4/h2,4H2,1H3
InChIKeyBCDGQXUMWHRQCB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
aminoacetone (CHEBI:17906) has functional parent acetone (CHEBI:15347)
aminoacetone (CHEBI:17906) has role Escherichia coli metabolite (CHEBI:76971)
aminoacetone (CHEBI:17906) has role mouse metabolite (CHEBI:75771)
aminoacetone (CHEBI:17906) is a methyl ketone (CHEBI:51867)
aminoacetone (CHEBI:17906) is a propanones (CHEBI:26292)
aminoacetone (CHEBI:17906) is conjugate base of ammonioacetone (CHEBI:58320)
Incoming Relation(s)
ammonioacetone (CHEBI:58320) is conjugate acid of aminoacetone (CHEBI:17906)
IUPAC Name 
1-aminopropan-2-one
Synonyms  Source
AminoacetoneKEGG COMPOUND
1-Amino-2-propanoneKEGG COMPOUND
1-AMINO-PROPAN-2-ONEPDBeChem
Manual XrefsDatabases
C01888KEGG COMPOUND
C01888KEGG COMPOUND
Registry NumbersSources
CAS:298-08-8KEGG COMPOUND
CAS:298-08-8ChemIDplus