Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:10:15 UTC
Update Date2025-03-24 22:31:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01228441
Frequency1.1
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESO=CC(O)C1CCCC1=O
InChI KeyHCWFPBKNNLKRES-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydroxyaldehydes
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • cyclic ketone
  • ketone
  • organic oxide
  • alpha-hydroxyaldehyde
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative