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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:35 UTC
Update Date2025-03-25 00:55:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214291
Frequency0.5
Structure
Chemical FormulaC12H15N3O2
Molecular Mass233.1164
SMILESCN(C)C(=N)NC(=Cc1ccccc1)C(=O)O
InChI KeyLCDJTKIHWCHOPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass cinnamic acids and derivatives
Direct Parent cinnamic acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha amino acids
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • guanidines
  • hydrocarbon derivatives
  • imines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • guanidine
  • imine
  • alpha-amino acid or derivatives
  • carboximidamide
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • cinnamic acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound