Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:38:12 UTC
Update Date2025-03-24 22:09:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02010279
Frequency0.6
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESCC1CCC(OO)CC1C
InChI KeyAFBKLBVYTDNTGS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic hydroperoxides
Subclass organic hydroperoxides
Direct Parent organic hydroperoxides
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alkyl hydroperoxides
  • hydrocarbon derivatives
  • peroxols
  • Substituents
  • alkyl hydroperoxide
  • aliphatic homomonocyclic compound
  • hydroperoxide
  • hydrocarbon derivative
  • peroxol
  • organooxygen compound