Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:07:24 UTC
Update Date2025-03-21 20:47:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00360547
Frequency5.2
Structure
Chemical FormulaC6H12O3
Molecular Mass132.0786
SMILESCC(=O)OOC(C)(C)C
InChI KeySWAXTRYEYUTSAP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass peroxycarboxylic acids and derivatives
Direct Parent peroxycarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acetate salts
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organic salts
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acetate salt
  • peroxycarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic salt
  • organooxygen compound