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Record Information
HMDB Statuspredicted
Creation Date2024-02-21 00:25:47 UTC
Update Date2025-03-21 18:39:06 UTC
HMDB IDHMDB0131468
Metabolite Identification
DeepMet IDDMID00124111
Name2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amino}acetic acid
Frequency32.6
Structure
Chemical FormulaC11H13NO5
Molecular Mass239.0794
SMILESCOc1cc(OC)cc(C(O)=NCC(=O)O)c1
InChI KeyUFBSPOIKQBQXCT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • carbonyl compounds
  • carboximidic acids
  • carboxylic acids
  • dimethoxybenzenes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • phenol ether
  • carboximidic acid
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • alkyl aryl ether
  • propargyl-type 1,3-dipolar organic compound
  • dimethoxybenzene
  • 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
  • m-dimethoxybenzene
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound