Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:09 UTC
Update Date2025-03-21 18:35:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108302
Frequency24.8
Structure
Chemical FormulaC16H26O5
Molecular Mass298.178
SMILESCC12CC(O)C3(C)C(CCC3(O)C(O)CO)C1CCC2=O
InChI KeyYNYSDFMZQMBWPH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic alcohol
  • aliphatic homopolycyclic compound
  • ketone
  • tertiary alcohol
  • organic oxide
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol