Hmdb loader

Showing information for DMID02168133

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:29 UTC
Update Date2025-03-25 00:48:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168133
Frequency0.5
Structure
Chemical FormulaC19H26O8
Molecular Mass382.1628
SMILESCC(Cc1ccc(C(C)C(=O)OC2CC(O)C(O)C(O)C2O)cc1)C(=O)O
InChI KeyNDGKTMUBWIZEPF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classphenylpropanoic acids
Subclass phenylpropanoic acids
Direct Parent phenylpropanoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic monoterpenoids
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • cyclitols and derivatives
  • cyclohexanols
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • phenylpropanes
    • Substituents
  • alcohol
  • monoterpenoid
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • cyclohexanol
  • cyclitol or derivatives
  • p-cymene
  • cyclic alcohol
  • carboxylic acid derivative
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aromatic monoterpenoid