Hmdb loader

Showing information for DMID02176030

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:55 UTC
Update Date2025-03-25 00:49:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176030
Frequency0.5
Structure
Chemical FormulaC13H16O3
Molecular Mass220.1099
SMILESCC1OCC2C(c3ccc(O)cc3)OCC12
InChI KeyKFGIJEQBCLUKHF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurofurans
Subclass furofurans
Direct Parent furofurans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • monocyclic benzene moiety
  • ether
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • furofuran
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound