Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:27:45 UTC
Update Date2025-03-24 22:13:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01124748
Frequency1.2
Structure
Chemical FormulaC6H11N3O
Molecular Mass141.0902
SMILESO=C1NCC2CNCC2N1
InChI KeyZNKPTOKUJWVNBM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • dialkylamines
  • diazinanes
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • pyrimidone
  • secondary amine
  • aliphatic heteropolycyclic compound
  • 1,3-diazinane
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine