Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:41:27 UTC
Update Date2025-03-25 01:08:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02295880
Frequency0.5
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESCCCC1CC1(O)C(=O)O
InChI KeyBMFQEPXOQVWSNM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass cyclopropanecarboxylic acids and derivatives
Direct Parent cyclopropanecarboxylic acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • hydroxy acid
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclopropanol
  • cyclopropanecarboxylic acid
  • organooxygen compound