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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:13 UTC
Update Date2025-03-21 18:36:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00113291
Frequency23.4
Structure
Chemical FormulaC14H20O7
Molecular Mass300.1209
SMILESO=C(CCC(O)Cc1cc(O)cc(O)c1)OCC(O)CO
InChI KeyGCDXIOWZGHVCKS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenediols
Direct Parent resorcinols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 1-monoacylglycerols
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • glycerolipids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-acyl-sn-glycerol
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxylic acid derivative
  • resorcinol
  • aromatic homomonocyclic compound
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • glycerolipid
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound