Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:34 UTC
Update Date2025-03-21 18:39:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123640
Frequency20.8
Structure
Chemical FormulaC16H15NO
Molecular Mass237.1154
SMILESOc1ccc(CCc2c[nH]c3ccccc23)cc1
InChI KeyHGVBWSMRYSCQDV-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
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • monocyclic benzene moiety
  • azacycle
  • indole
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound