Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:52:22 UTC
Update Date2025-03-24 20:55:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01615066
Frequency0.8
Structure
Chemical FormulaC6H10N2O
Molecular Mass126.0793
SMILESCCc1cc(CO)[nH]n1
InChI KeyBPJLSYGANNQDOB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass pyrazoles
Direct Parent pyrazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrazole
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound