Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:21:07 UTC
Update Date2025-03-24 20:01:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01108546
Frequency1.2
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC(C(=O)O)C1(O)CC1
InChI KeyIUFDJXFUUAZFSZ-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
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclopropanol