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CHEBI:15743 - butanal

ChEBI IDCHEBI:15743
ChEBI Namebutanal
Stars
DefinitionA member of the class of butanals that consists of propane bearing a formyl substituent at the 1-position. The parent of the class of butanals.
Secondary ChEBI IDsCHEBI:3233, CHEBI:13923, CHEBI:22938
Last Modified27 January 2016
DownloadsMolfile

FormulaC4H8O
Net Charge0
Average Mass72.107
Monoisotopic Mass72.05751
SMILES[H]C(=O)CCC
InChIInChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3
InChIKeyZTQSAGDEMFDKMZ-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification

ChEBI Ontology
IUPAC Name 
butanal
Synonyms  Source
ButanalKEGG COMPOUND
ButyraldehydeKEGG COMPOUND
Aldeide butirrica  esChemIDplus
Butyraldehyd  deChemIDplus
ButylaldehydeChemIDplus
Butyric aldehydeChemIDplus
UniProt Name  Source
butanalUniProt
Manual XrefsDatabases
C01412KEGG COMPOUND
C01412KEGG COMPOUND
HMDB0003543HMDB
BUTANALMetaCyc
ButanalWikipedia
Registry NumbersSources
Reaxys:506061Reaxys
CAS:123-72-8KEGG COMPOUND
CAS:123-72-8ChemIDplus
CAS:123-72-8NIST Chemistry WebBook
Citations