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Showing information for DMID00103391

Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:17:10 UTC
Update Date2025-03-21 18:35:00 UTC
HMDB IDHMDB0038926
Metabolite Identification
DeepMet IDDMID00103391
NameSamin
Frequency26.3
Structure
Chemical FormulaC13H14O5
Molecular Mass250.0841
SMILESOC1OCC2C(c3ccc4c(c3)OCO4)OCC12
InChI KeyDRUQKRWRXOUEGS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxoles
Subclass benzodioxoles
Direct Parent benzodioxoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • benzenoids
  • dialkyl ethers
  • furofurans
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • ether
  • tetrahydrofuran
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • furofuran
  • hemiacetal
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • benzodioxole