Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:54 UTC
Update Date2025-03-25 00:51:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187412
Frequency0.5
Structure
Chemical FormulaC7H14O3
Molecular Mass146.0943
SMILESCC(C)C(CO)C(=O)CO
InChI KeyCENZOAUJRLIVTO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • beta-hydroxy ketones
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • monosaccharide
  • alpha-hydroxy ketone
  • ketone
  • organic oxide
  • hydrocarbon derivative
  • primary alcohol