Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:16:45 UTC
Update Date2025-03-24 16:45:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00954663
Frequency1.5
Structure
Chemical FormulaC7H10O
Molecular Mass110.0732
SMILESOC12C=CC(CC1)C2
InChI KeyBXKVMQAJHSXYHX-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