Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:18:51 UTC
Update Date2025-03-25 01:23:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02382664
Frequency0.5
Structure
Chemical FormulaC5H10O2
Molecular Mass102.0681
SMILESCC1(O)CC(O)C1
InChI KeyJBKPAMWOSAMZIV-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
  • secondary alcohols
  • Substituents
  • tertiary alcohol
  • cyclobutanol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative