Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:15 UTC
Update Date2025-03-25 00:58:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231571
Frequency0.5
Structure
Chemical FormulaC11H12O4
Molecular Mass208.0736
SMILESCC1OC2Oc3cc(O)ccc3C2C1O
InChI KeyUZPZEJRFOXEMSL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classcoumarans
Subclass coumarans
Direct Parent coumarans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • acetals
  • benzenoids
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • coumaran
  • organooxygen compound