Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:39 UTC
Update Date2025-03-21 18:02:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040074
Frequency86.4
Structure
Chemical FormulaC12H16O
Molecular Mass176.1201
SMILESC=CC=CC1C=CC(=O)CC1(C)C
InChI KeyYVFDEPVIJKOWNF-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