Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:24 UTC
Update Date2025-03-25 00:56:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220801
Frequency0.5
Structure
Chemical FormulaC17H15NO4
Molecular Mass297.1001
SMILESO=C(O)CCc1cc2ccccc2c2c(CC(=O)O)c[nH]c12
InChI KeyGSMFMFSTPBFVNG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • indole
  • heteroaromatic compound
  • indole or derivatives
  • carboxylic acid derivative
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound