Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:34:34 UTC
Update Date2025-03-21 17:56:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00002806
Frequency2110.8
Structure
Chemical FormulaC7H12O8
Molecular Mass224.0532
SMILESO=C(O)C(O)C(O)C(O)C(O)C(=O)CO
InChI KeyCLVVMHAMVXLXBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent glucuronic acid derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyloins
  • alpha hydroxy acids and derivatives
  • alpha-hydroxy ketones
  • beta hydroxy acids and derivatives
  • beta-hydroxy ketones
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • medium-chain fatty acids
  • medium-chain hydroxy acids and derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • Substituents
  • fatty acyl
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • glucuronic acid or derivatives
  • alpha-hydroxy acid
  • monosaccharide
  • fatty acid
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • medium-chain hydroxy acid
  • ketone
  • beta-hydroxy acid
  • organic oxide
  • medium-chain fatty acid
  • hydroxy fatty acid
  • alcohol
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative