Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:15 UTC
Update Date2025-03-25 00:48:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167600
Frequency0.5
Structure
Chemical FormulaC9H13N5O
Molecular Mass207.112
SMILESCC(C)Cn1ncc2c(=O)[nH]c(N)nc21
InChI KeyVPJZWNALAAEZNY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrazolopyrimidines
Subclass pyrazolo[3,4-d]pyrimidines
Direct Parent pyrazolo[3,4-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrazoles
  • pyrimidones
  • vinylogous amides
  • Substituents
  • pyrazolo[3,4-d]pyrimidine
  • vinylogous amide
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • pyrazole
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound
  • azole