Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:50:51 UTC
Update Date2025-03-24 17:59:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01036274
Frequency1.3
Structure
Chemical FormulaC6H8O4
Molecular Mass144.0423
SMILESCC(=O)CC(O)C(O)=C=O
InChI KeyPMOQNWBIJKAYPS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-hydroxy ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • ynolates
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • secondary alcohol
  • hydrocarbon derivative