Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:24:02 UTC
Update Date2025-03-24 22:03:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01976338
Frequency0.6
Structure
Chemical FormulaC5H6O2
Molecular Mass98.0368
SMILESC=C=CC(=O)CO
InChI KeyYONPHIAZKPDIFR-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
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • alpha-hydroxy ketone
  • enone