Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:48:23 UTC
Update Date2025-03-21 20:04:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00315720
Frequency6.2
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC(C)C(=O)OCC=O
InChI KeyCSHAFUNPZJHCDD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-acyloxy aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid ester
  • aldehyde
  • hydrocarbon derivative
  • carboxylic acid derivative
  • alpha-acyloxy aldehyde