Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:36:45 UTC
Update Date2025-03-24 17:53:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01002382
Frequency1.4
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESO=C(O)CC(=O)C1CCC1
InChI KeyHEIOJOQSDYLZGU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass beta-keto acids and derivatives
Direct Parent beta-keto acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • beta-hydroxy ketones
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • beta-hydroxy ketone
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • beta-keto acid
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound