Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:26 UTC
Update Date2025-03-25 00:56:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02216167
Frequency0.5
Structure
Chemical FormulaC7H14O
Molecular Mass114.1045
SMILESCCCC1CC(O)C1
InChI KeyLPJXHKYTLWYCMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • cyclobutanol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative