Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:46 UTC
Update Date2025-03-25 00:59:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02237309
Frequency0.5
Structure
Chemical FormulaC20H19NO5
Molecular Mass353.1263
SMILESO=C(CCc1ccc(O)cc1)OC(Cc1c[nH]c2ccccc12)C(=O)O
InChI KeyOPUXZRBYFYERQN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • indole
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • azacycle
  • heteroaromatic compound
  • fatty acid ester
  • organic oxygen compound
  • carboxylic acid ester
  • pyrrole
  • dicarboxylic acid or derivatives
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound