Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:13 UTC
Update Date2025-03-25 01:00:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02242910
Frequency0.5
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESC1=CC2C(O1)OC1OCC12
InChI KeyKUZQSAHRDWMFHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurofurans
Subclass furofurans
Direct Parent furofurans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxepanes
  • acetals
  • dihydrofurans
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxetanes
  • tetrahydrofurans
  • Substituents
  • 1,3-dioxepane
  • tetrahydrofuran
  • dioxepane
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • acetal
  • furofuran
  • oxetane
  • hydrocarbon derivative
  • organooxygen compound
  • dihydrofuran