Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:13:48 UTC
Update Date2025-03-24 21:32:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01810478
Frequency0.7
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCC(CO)C1(O)CCC1
InChI KeyBULAVXWLNYYKMP-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
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • primary alcohols
  • Substituents
  • tertiary alcohol
  • cyclobutanol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol