Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:43:38 UTC
Update Date2025-03-21 17:59:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00023456
Frequency167.5
Structure
Chemical FormulaC8H14O6
Molecular Mass206.079
SMILESCC(=O)OC1OC(C)C(O)C(O)C1O
InChI KeyVNWLUVCBYSFSIM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • monosaccharide
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • acetal
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • organoheterocyclic compound