Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:51 UTC
Update Date2025-03-25 00:50:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178196
Frequency0.5
Structure
Chemical FormulaC11H9N3O
Molecular Mass199.0746
SMILESCn1c(=O)cnc2[nH]c3ccccc3c21
InChI KeyBPNIYTLRPWTHGR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrazines
Subclass pyrrolopyrazines
Direct Parent pyrrolopyrazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrazines
  • pyrroles
  • Substituents
  • lactam
  • azacycle
  • indole
  • heteroaromatic compound
  • indole or derivatives
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyrrolopyrazine
  • organooxygen compound