Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:28:35 UTC
Update Date2025-03-21 23:18:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00694852
Frequency2.2
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESO=C1CCC(C(O)CO)C1
InChI KeyDYCKUPMXMGAVSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • ketone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • 1,2-diol