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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:22 UTC
Update Date2025-03-21 18:33:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00094082
Frequency29.6
Structure
Chemical FormulaC10H12O2
Molecular Mass164.0837
SMILESOc1ccc(C2CCCO2)cc1
InChI KeyIUSPLBQETIEWCQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound