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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:21 UTC
Update Date2025-03-25 00:47:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163226
Frequency0.5
Structure
Chemical FormulaC9H14O8
Molecular Mass250.0689
SMILESO=C(O)C1C(O)C(O)C2C(O)C(O)C(O)OC12
InChI KeyWUBFWELKTCAIQN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • monosaccharide
  • cyclic alcohol
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • oxacycle
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organoheterocyclic compound
  • organooxygen compound