Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:40:46 UTC
Update Date2025-03-25 01:08:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02294338
Frequency0.5
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESCC(=O)OC1CC1O
InChI KeyITEJLPKWCYDUKJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • carbonyl group
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid ester
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclopropanol