Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:22:07 UTC
Update Date2025-03-21 20:54:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00395443
Frequency4.6
Structure
Chemical FormulaC5H7NO4
Molecular Mass145.0375
SMILESO=CC(CCC(=O)O)=NO
InChI KeyKBWJVBPLISPBDR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent fatty acids and conjugates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • carboxylic acids
  • hydrocarbon derivatives
  • ketoximes
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty acid
  • aldehyde
  • ketoxime
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound