Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:16:58 UTC
Update Date2025-03-24 21:06:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01674747
Frequency0.7
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESCC1=CC2(C)CC1CC2=O
InChI KeyQKDJBRUUHNJFOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • cyclohexenone
  • organic oxide
  • hydrocarbon derivative
  • aliphatic homopolycyclic compound