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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:47 UTC
Update Date2025-03-25 00:46:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152948
Frequency0.5
Structure
Chemical FormulaC15H17NO9
Molecular Mass355.0903
SMILESNC(=O)Cc1ccc(OC2OC(C(=O)O)C(O)C(O)C2C(=O)O)cc1
InChI KeyXIZOTNUHSPTFPL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acetals
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • primary carboxylic acid amides
  • pyran carboxylic acids
  • secondary alcohols
  • Substituents
  • primary carboxylic acid amide
  • phenol ether
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • phenylacetamide
  • organoheterocyclic compound
  • 1,2-diol
  • alcohol
  • pyran carboxylic acid or derivatives
  • hydroxy acid
  • carboxamide group
  • oxacycle
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound