Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:57:33 UTC
Update Date2025-03-21 18:05:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00056324
Frequency56.6
Structure
Chemical FormulaC4H8N2O2
Molecular Mass116.0586
SMILESO=C1NCC(O)CN1
InChI KeyPZSCGIVZIUKDAJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • diazinanes
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • pyrimidone
  • 1,3-diazinane
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound