Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:44:40 UTC
Update Date2025-03-25 00:24:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01310343
Frequency1.0
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESO=C1CC(CO)CCC1O
InChI KeyPNHNCXMMTZZZQD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • cyclic alcohol
  • ketone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol