Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:32:04 UTC
Update Date2025-03-24 14:28:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00847919
Frequency1.7
Structure
Chemical FormulaC6H12O
Molecular Mass100.0888
SMILESCC1(C)CC1(C)O
InChI KeyGRZLMAHWSCCNHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclopropanol