Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:30 UTC
Update Date2025-03-25 00:51:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188777
Frequency0.5
Structure
Chemical FormulaC12H16O
Molecular Mass176.1201
SMILESCC1(C)C2C=CC3CCC(=O)C31C2
InChI KeyPQLWEJYNUWPLII-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent bicyclic monoterpenoids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • pinane monoterpenoid
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound
  • aliphatic homopolycyclic compound