Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:18 UTC
Update Date2025-03-25 01:00:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240792
Frequency0.5
Structure
Chemical FormulaC12H20O8
Molecular Mass292.1158
SMILESCC(=O)OC1C(O)C(O)C(O)C(O)C1OC(=O)C(C)C
InChI KeyJILKOZMIRMYWQX-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
  • carbonyl compounds
  • carboxylic acid esters
  • cyclitols and derivatives
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • carboxylic acid derivative
  • organic oxide
  • carboxylic acid ester
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative