Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:44:55 UTC
Update Date2025-03-24 22:12:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02026384
Frequency0.6
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCCC=CCC(=O)OO
InChI KeyGNLNBOLQYNOZIL-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
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic hydroperoxides
  • organic oxides
  • peroxols
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • peroxycarboxylic acid or derivatives
  • hydroperoxide
  • hydrocarbon derivative
  • peroxol
  • organooxygen compound