Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:00:10 UTC
Update Date2025-03-21 18:55:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00204603
Frequency10.9
Structure
Chemical FormulaC6H12O3
Molecular Mass132.0786
SMILESCC1(O)COCC(O)C1
InChI KeyMCYXFILAHWSONM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • ether
  • dialkyl ether
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • organooxygen compound