Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:01 UTC
Update Date2025-03-25 00:47:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160209
Frequency0.5
Structure
Chemical FormulaC13H19NO6
Molecular Mass285.1212
SMILESNc1ccccc1OC1C(CO)OC(CO)C(O)C1O
InChI KeyJXXFCRHXCKXOOJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • primary alcohols
  • primary amines
  • secondary alcohols
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • monosaccharide
  • alkyl aryl ether
  • dialkyl ether
  • saccharide
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • organooxygen compound