Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:03:59 UTC
Update Date2025-03-24 22:29:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01212558
Frequency1.1
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESCOC1CCCC(C)(O)C1
InChI KeyDNLJDRYEAHWZRD-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
  • dialkyl ethers
  • hydrocarbon derivatives
  • tertiary alcohols
  • Substituents
  • tertiary alcohol
  • ether
  • cyclohexanol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol
  • dialkyl ether