Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:45 UTC
Update Date2025-03-25 01:01:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246561
Frequency0.5
Structure
Chemical FormulaC9H18O2
Molecular Mass158.1307
SMILESCCC(O)C1CCC(C)(O)C1
InChI KeyBMXWCFQGSRAZEO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclopentanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • tertiary alcohols
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol
  • cyclopentanol