Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:19:50 UTC
Update Date2025-03-24 20:01:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01105456
Frequency1.2
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESOC1C=CC(O)C(O)CC1
InChI KeyJBOAREKPLGCXEZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative