Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:21:27 UTC
Update Date2025-03-24 21:08:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01685722
Frequency0.7
Structure
Chemical FormulaC4H8O4
Molecular Mass120.0423
SMILESOC1COCC1(O)O
InChI KeyYLJIFVADUQXDLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl hydrates
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • carbonyl hydrate
  • tetrahydrofuran
  • monosaccharide
  • dialkyl ether
  • oxacycle
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound