Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:57 UTC
Update Date2025-03-21 18:04:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00052693
Frequency61.7
Structure
Chemical FormulaC9H18O2
Molecular Mass158.1307
SMILESCC(C)(O)C1CCC(O)CC1
InChI KeySWTXIPGMIMZAIE-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
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • tertiary alcohols
  • Substituents
  • tertiary alcohol
  • cyclohexanol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol