Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:27 UTC
Update Date2025-03-25 00:50:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179522
Frequency0.5
Structure
Chemical FormulaC15H17N3O2
Molecular Mass271.1321
SMILESCOc1ccc2ncc(C3CCCN3C(C)=O)nc2c1
InChI KeyQTIKERTWLLKEPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinoxalines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-acylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrazines
  • tertiary carboxylic acid amides
  • Substituents
  • phenol ether
  • carbonyl group
  • ether
  • n-acylpyrrolidine
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • acetamide
  • quinoxaline
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • organic oxygen compound
  • anisole
  • pyrazine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound