Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:06:06 UTC
Update Date2025-03-24 21:01:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01648493
Frequency0.8
Structure
Chemical FormulaC7H10N2O
Molecular Mass138.0793
SMILESCCc1nc[n+]([O-])cc1C
InChI KeyYUBLIMGPDDGPOC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • organic oxide
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrimidine