Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:09:32 UTC
Update Date2025-03-24 19:55:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01080062
Frequency1.3
Structure
Chemical FormulaC4H8O4
Molecular Mass120.0423
SMILESO=CC(O)CC(O)O
InChI KeyKQJKQQAOIMAMTK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydroxyaldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl hydrates
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • short-chain aldehydes
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • short-chain aldehyde
  • carbonyl hydrate
  • organic oxide
  • alpha-hydroxyaldehyde
  • secondary alcohol
  • hydrocarbon derivative