Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:13:40 UTC
Update Date2025-03-21 19:07:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00235846
Frequency9.0
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESCC(O)=CC(=O)CO
InChI KeyQJVYUVSOLNQQOP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydroxy ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • alcohols and polyols
  • enones
  • hydrocarbon derivatives
  • organic oxides
  • vinylogous acids
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • alpha,beta-unsaturated ketone
  • alpha-hydroxy ketone
  • vinylogous acid
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • enone