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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:41:11 UTC
Update Date2025-03-21 17:58:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00017942
Frequency232.8
Structure
Chemical FormulaC10H11NO4
Molecular Mass209.0688
SMILESCOc1cc(C=NCC(=O)O)ccc1O
InChI KeyGEMZVAIWUUBLGZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass methoxyphenols
Direct Parent methoxyphenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aldimines
  • alkyl aryl ethers
  • alpha amino acids
  • anisoles
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • methoxybenzenes
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • phenoxy compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • imine
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • alpha-amino acid or derivatives
  • alkyl aryl ether
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • aldimine
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organic 1,3-dipolar compound
  • methoxybenzene
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound