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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:28 UTC
Update Date2025-03-21 17:59:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00020811
Frequency193.7
Structure
Chemical FormulaC9H10O4
Molecular Mass182.0579
SMILESOC1Oc2ccccc2C(O)C1O
InChI KeyILBNGKAPDYKWNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • benzenoids
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • 1-benzopyran
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • 1,2-diol