Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:31 UTC
Update Date2025-03-25 00:47:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159154
Frequency0.5
Structure
Chemical FormulaC12H16O6
Molecular Mass256.0947
SMILESOCc1ccc(C2OC(CO)C(O)C2O)cc1O
InChI KeyVEWZNOQRSBMMPG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzyl alcohols
Direct Parent benzyl alcohols
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aromatic alcohols
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • aromatic alcohol
  • alcohol
  • ether
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • benzyl alcohol
  • 1-hydroxy-4-unsubstituted benzenoid
  • dialkyl ether
  • oxacycle
  • saccharide
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound