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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:34:40 UTC
Update Date2025-03-21 17:56:42 UTC
HMDB IDHMDB0031195
Metabolite Identification
DeepMet IDDMID00003056
Name3,5,5-Trimethyl-2-cyclohexen-1-one
Frequency1936.2
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC1=CC(=O)CC(C)(C)C1
InChI KeyHJOVHMDZYOCNQW-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
  • Substituents
  • cyclohexenone
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative