Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:55:20 UTC
Update Date2025-03-24 20:31:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01478452
Frequency0.9
Structure
Chemical FormulaC10H7N
Molecular Mass141.0578
SMILESc1ccc2c3ccc([nH]3)c2c1
InChI KeyNIPXSDPASMUSFR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • isoindoles
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • azacycle
  • isoindole
  • heteroaromatic compound
  • naphthalene
  • aromatic heteropolycyclic compound
  • isoindole or derivatives
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound