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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:03 UTC
Update Date2025-03-25 00:57:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222313
Frequency0.5
Structure
Chemical FormulaC13H15NO5
Molecular Mass265.095
SMILESOCC1OOC(c2cc3ccccc3[nH]2)C(O)C1O
InChI KeyKUTOLBQOQWGRSJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-dioxanes
  • azacyclic compounds
  • benzenoids
  • dialkyl peroxides
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrroles
  • secondary alcohols
  • Substituents
  • alcohol
  • azacycle
  • indole
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • dialkyl peroxide
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • primary alcohol
  • ortho-dioxane
  • organooxygen compound