Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:42:44 UTC
Update Date2025-03-24 21:45:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01878718
Frequency0.6
Structure
Chemical FormulaC9H6N2
Molecular Mass142.0531
SMILESC1=Nc2cccc3[nH]cc1c23
InChI KeyLGGLNYYXAOJNTN-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
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrroles
  • Substituents
  • azacycle
  • indole
  • imine
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound