Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:47 UTC
Update Date2025-03-21 18:38:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00121853
Frequency21.2
Structure
Chemical FormulaC8H14O6
Molecular Mass206.079
SMILESCCOC1OC(C(=O)O)C(O)CC1O
InChI KeyYYPLPMGNTBNGLD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyran carboxylic acids and derivatives
Direct Parent pyran carboxylic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • pyran carboxylic acid or derivatives
  • monosaccharide
  • hydroxy acid
  • carboxylic acid derivative
  • oxacycle
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • organooxygen compound