Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:57:14 UTC
Update Date2025-03-21 23:01:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00620874
Frequency2.6
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESO=C(O)CC1CN1
InChI KeyXMSRXXWTJOALRG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • aziridines
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • azacycle
  • amino acid
  • secondary amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • aziridine
  • organoheterocyclic compound
  • organooxygen compound
  • amine