Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:10:11 UTC
Update Date2025-03-24 21:30:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01801563
Frequency0.7
Structure
Chemical FormulaC8H12O
Molecular Mass124.0888
SMILESOC12C=CC(CCC1)C2
InChI KeyRIRRIDQXBQJPIX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • hydrocarbon derivative
  • cyclic alcohol
  • aliphatic homopolycyclic compound