Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:05 UTC
Update Date2025-03-25 00:52:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196794
Frequency0.5
Structure
Chemical FormulaC12H18O2
Molecular Mass194.1307
SMILESCCC=CCC1CC(O)C(=O)C=C1C
InChI KeyVSWQNVGNONASDU-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
  • secondary alcohols
  • Substituents
  • alcohol
  • cyclohexenone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative