Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:01:47 UTC
Update Date2025-03-21 22:04:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00489397
Frequency3.5
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESCC1CCC(C)(OO)CC1
InChI KeyCNWQSIZKPYDPQD-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