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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:18:04 UTC
Update Date2025-03-24 21:34:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01820832
Frequency0.7
Structure
Chemical FormulaC5H10N2
Molecular Mass98.0844
SMILESC1=NCCCCN1
InChI KeyDENXBHJBFMGWBK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazepines
Subclass 1,3-diazepines
Direct Parent 1,3-diazepines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • formamidines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • meta-diazepine
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound