Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:34:12 UTC
Update Date2025-03-21 17:56:32 UTC
HMDB IDHMDB0003543
Metabolite Identification
DeepMet IDDMID00001919
NameButanal
Frequency3171.0
Structure
Chemical FormulaC4H8O
Molecular Mass72.0575
SMILESCCCC=O
InChI KeyZTQSAGDEMFDKMZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • short-chain aldehydes
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • short-chain aldehyde
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative