Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:10 UTC
Update Date2025-03-25 00:47:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165130
Frequency0.5
Structure
Chemical FormulaC13H20O
Molecular Mass192.1514
SMILESCC=CC(=O)C1=C(C)CCC1C(C)C
InChI KeyQNRIGIRBHQCFAR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent monocyclic monoterpenoids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alpha,beta-unsaturated ketones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • carbonyl group
  • organic oxide
  • monocyclic monoterpenoid
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • alpha,beta-unsaturated ketone
  • organooxygen compound