Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:53:18 UTC
Update Date2025-03-21 22:00:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00469399
Frequency3.7
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESO=C1CCC(CO)CC1
InChI KeyKHMBXNKCMNGLKG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclic ketones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • Substituents
  • alcohol
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic ketone
  • primary alcohol