Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:33:49 UTC
Update Date2025-03-21 17:56:24 UTC
HMDB IDHMDB0000734
Metabolite Identification
DeepMet IDDMID00001053
NameIndoleacrylic acid
Frequency5496.0
Structure
Chemical FormulaC11H9NO2
Molecular Mass187.0633
SMILESO=C(O)C=Cc1c[nH]c2ccccc12
InChI KeyPLVPPLCLBIEYEA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • indole
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound