Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:34 UTC
Update Date2025-03-21 18:40:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00128425
Frequency19.8
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC1CCC(O)(C=O)CC1
InChI KeyLRRJZOPKENOGLV-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
  • aldehydes
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • tertiary alcohol
  • organic oxide
  • cyclohexanol
  • aliphatic homomonocyclic compound
  • aldehyde
  • hydrocarbon derivative
  • cyclic alcohol