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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:58 UTC
Update Date2025-03-25 00:55:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02215129
Frequency0.5
Structure
Chemical FormulaC18H26O8
Molecular Mass370.1628
SMILESCC1CC(O)C(O)C(O)C1OC(=O)CCC(O)Cc1cc(O)cc(O)c1
InChI KeyFZMWKIVOQKCEEB-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
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • cyclitols and derivatives
  • cyclohexanols
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • alcohol
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • cyclohexanol
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclitol or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • cyclic alcohol
  • carboxylic acid derivative
  • resorcinol
  • aromatic homomonocyclic compound
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound