Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:11 UTC
Update Date2025-03-25 00:50:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181234
Frequency0.5
Structure
Chemical FormulaC10H16O6
Molecular Mass232.0947
SMILESO=C(O)CC1(CC(=O)O)CC(O)CC(O)C1
InChI KeyWOZCCDDKBNFZAK-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 acids
  • cyclic alcohols and derivatives
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • cyclohexanol
  • cyclic alcohol
  • carboxylic acid derivative
  • organic oxide
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative