Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:13:45 UTC
Update Date2025-03-25 00:37:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02094662
Frequency0.6
Structure
Chemical FormulaC6H8O2
Molecular Mass112.0524
SMILESC=C(C)C=C(O)C=O
InChI KeyAYOFDPSIRPHGBD-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
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • alpha-hydroxyaldehyde
  • hydrocarbon derivative