Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:32:08 UTC
Update Date2025-03-24 14:28:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00848094
Frequency1.7
Structure
Chemical FormulaC7H12O
Molecular Mass112.0888
SMILESCC1(C)C2CC(O)C21
InChI KeyKKRNFYGEGUSQQJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • cyclobutanol
  • secondary alcohol
  • hydrocarbon derivative
  • cyclic alcohol
  • aliphatic homopolycyclic compound