Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:02:58 UTC
Update Date2025-03-21 19:01:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00211093
Frequency10.4
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC12CCC(O1)C(C)(O)C2
InChI KeyDBQOWBHLGSJCKN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • tetrahydrofuran
  • monosaccharide
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • tertiary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound