Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:11:35 UTC
Update Date2025-03-24 21:31:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01804965
Frequency0.7
Structure
Chemical FormulaC4H8O3
Molecular Mass104.0473
SMILESOCC1(O)CC1O
InChI KeyBMNXUJQSPJSGAE-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
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclopropanol