Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:34:23 UTC
Update Date2025-03-21 17:56:35 UTC
HMDB IDHMDB0010720
Metabolite Identification
DeepMet IDDMID00002378
NameBut-2-enoic acid
Frequency2566.4
Structure
Chemical FormulaC4H6O2
Molecular Mass86.0368
SMILESCC=CC(=O)O
InChI KeyLDHQCZJRKDOVOX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent straight chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • unsaturated fatty acids
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • straight chain fatty acid
  • carboxylic acid
  • carboxylic acid derivative
  • unsaturated fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound