Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:19 UTC
Update Date2025-03-21 18:41:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134788
Frequency18.6
Structure
Chemical FormulaC9H14O2
Molecular Mass154.0994
SMILESCC1=CC(=O)CC(C)(O)C1C
InChI KeyLBZJKSFEUTZXGC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclohexenone
  • tertiary alcohol
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative