Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:51:51 UTC
Update Date2025-03-25 00:26:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01327707
Frequency1.0
Structure
Chemical FormulaC5H6N2O2
Molecular Mass126.0429
SMILESO=C1NC2C(N1)C1OC21
InChI KeyFELMIUBLCULTCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazepanes
Subclass 1,3-diazepanes
Direct Parent 1,3-diazepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • imidazolidinones
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • imidazolidine
  • 1,3-diazepane
  • carbonyl group
  • ether
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • oxirane
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • imidazolidinone
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound