Hmdb loader

Showing information for DMID00006230

Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:36:03 UTC
Update Date2025-03-21 17:57:11 UTC
HMDB IDHMDB0030819
Metabolite Identification
DeepMet IDDMID00006230
NameAesculetin
Frequency833.4
Structure
Chemical FormulaC9H6O4
Molecular Mass178.0266
SMILESO=c1ccc2cc(O)c(O)cc2o1
InChI KeyILEDWLMCKZNDJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcoumarins and derivatives
Subclass hydroxycoumarins
Direct Parent 6,7-dihydroxycoumarins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • 1-hydroxy-2-unsubstituted benzenoids
  • 7-hydroxycoumarins
  • benzenoids
  • coumarins and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
    • Substituents
  • benzopyran
  • 7-hydroxycoumarin
  • 1-benzopyran
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 6,7-dihydroxycoumarin
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • organooxygen compound