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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:14 UTC
Update Date2025-03-25 00:45:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151679
Frequency0.5
Structure
Chemical FormulaC10H12N4
Molecular Mass188.1062
SMILESN=C(N)N1CC=Nc2ccccc2C1
InChI KeyKXLFKYDLQZUKJP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodiazepines
Subclass 1,4-benzodiazepines
Direct Parent 1,4-benzodiazepines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • guanidine
  • imine
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • 1,4-benzodiazepine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound