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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:40 UTC
Update Date2025-03-25 00:46:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157257
Frequency0.5
Structure
Chemical FormulaC7H10N2O2
Molecular Mass154.0742
SMILESO=C1CN2CCCC1C(=O)N2
InChI KeyOTKVPSGIYXPAQT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazepanes
Subclass 1,2-diazepanes
Direct Parent 1,2-diazepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • azacyclic compounds
  • azepanes
  • carboxylic acid hydrazides
  • carboxylic acids and derivatives
  • diazinanes
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • carboxylic acid hydrazide
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • 1,2-diazepane
  • ketone
  • aliphatic heteropolycyclic compound
  • 1,2-diazinane
  • organic oxide
  • azepane
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound