Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:09:22 UTC
Update Date2025-03-24 21:56:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01941622
Frequency0.6
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESNC(=O)C1(O)CC1
InChI KeyLBHMIEZEXWDBJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass cyclopropanecarboxylic acids and derivatives
Direct Parent cyclopropanecarboxylic acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • tertiary alcohols
  • Substituents
  • primary carboxylic acid amide
  • alcohol
  • carbonyl group
  • cyclopropanecarboxylic acid or derivatives
  • carboxamide group
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • cyclopropanol
  • organic nitrogen compound
  • organooxygen compound