CHEBI:30322 - 3-acetamidopropanal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-acetamidopropanal
ChEBI ID CHEBI:30322
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB5928169, ZINC000060094177
Download Molfile XML SDF
Formula C5H9NO2
Net Charge 0
Average Mass 115.13050
Monoisotopic Mass 115.06333
InChI InChI=1S/C5H9NO2/c1-5(8)6-3-2-4-7/h4H,2-3H2,1H3,(H,6,8)
InChIKey ARJPPNFIEQKVBB-UHFFFAOYSA-N
SMILES [H]C(=O)CCNC(C)=O
ChEBI Ontology
Outgoing 3-acetamidopropanal (CHEBI:30322) has functional parent propanal (CHEBI:17153)
3-acetamidopropanal (CHEBI:30322) is a α-CH2-containing aldehyde (CHEBI:73359)
3-acetamidopropanal (CHEBI:30322) is a monocarboxylic acid amide (CHEBI:29347)
IUPAC Name
N-(3-oxopropyl)acetamide
Synonym Source
3-acetamidopropanal UniProt
Manual Xref Database
C18170 KEGG COMPOUND
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Registry Number Type Source
4364596 Beilstein Registry Number Beilstein
Last Modified
05 June 2015