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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:21 UTC
Update Date2025-03-25 00:49:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177030
Frequency0.5
Structure
Chemical FormulaC13H22O12
Molecular Mass370.1111
SMILESO=C(O)C1OC(O)C(CO)OC1OCC1C(O)C(O)C(O)C(O)C1O
InChI KeyZDGBNVASAAHUQO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,4-dioxanes
  • acetals
  • carbonyl compounds
  • carboxylic acids
  • cyclitols and derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • primary alcohols
    • Substituents
  • carbonyl group
  • carboxylic acid
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • acetal
  • para-dioxane
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound