Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:13:24 UTC
Update Date2025-03-21 23:11:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00658872
Frequency2.4
Structure
Chemical FormulaC7H12O
Molecular Mass112.0888
SMILESOC1CCC2CCC12
InChI KeyQPXNWUKXOGMANC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • secondary alcohol
  • hydrocarbon derivative
  • cyclic alcohol
  • aliphatic homopolycyclic compound