Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:02 UTC
Update Date2025-03-25 00:47:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164807
Frequency0.5
Structure
Chemical FormulaC10H18O2
Molecular Mass170.1307
SMILESCC(O)C1(O)C=CC(C)(C)CC1
InChI KeyQGAPQFATTZXXCR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • tertiary alcohol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,2-diol