Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:44:55 UTC
Update Date2025-03-21 21:57:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00449687
Frequency3.9
Structure
Chemical FormulaC5H9NO3
Molecular Mass131.0582
SMILESCNCC(=O)OC(C)=O
InChI KeyBZWNYPZNTQCGJE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid anhydrides
  • dialkylamines
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • secondary amine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • carboxylic acid anhydride
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine