Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:10:48 UTC
Update Date2025-03-21 20:49:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00368452
Frequency5.1
Structure
Chemical FormulaC7H12O
Molecular Mass112.0888
SMILESOC1CC(C2CC2)C1
InChI KeyADBUCUROQJNVPP-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