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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:21 UTC
Update Date2025-03-25 00:54:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02206589
Frequency0.5
Structure
Chemical FormulaC10H16O9
Molecular Mass280.0794
SMILESO=C(O)C(CO)OC1CC(C(=O)O)C(O)C(O)C1O
InChI KeyIJTQIKOAFJJWOY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclitols and derivatives
  • dialkyl ethers
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • sugar acids and derivatives
    • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • cyclohexanol
  • cyclitol or derivatives
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • dialkyl ether
  • beta-hydroxy acid
  • organic oxide
  • glyceric_acid
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • primary alcohol