Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:17 UTC
Update Date2025-03-21 18:38:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120626
Frequency21.5
Structure
Chemical FormulaC9H16O8
Molecular Mass252.0845
SMILESCC1OC(OCC(O)C(=O)O)C(O)C(O)C1O
InChI KeyMEMUMCAVCSOEAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent sugar acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alpha 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
  • alpha-hydroxy acid
  • monosaccharide
  • hydroxy acid
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • acetal
  • glyceric_acid
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • organoheterocyclic compound