Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:10 UTC
Update Date2025-03-21 17:57:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006507
Frequency793.0
Structure
Chemical FormulaC8H16O
Molecular Mass128.1201
SMILESCC1CCC(C)(O)CC1
InChI KeyAPFUOIYHVUKJKX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • tertiary alcohols
  • Substituents
  • tertiary alcohol
  • cyclohexanol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol