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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:46:20 UTC
Update Date2025-03-24 20:53:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01600804
Frequency0.8
Structure
Chemical FormulaC6H13N3O
Molecular Mass143.1059
SMILESNC(=O)NCC1CCNC1
InChI KeyJLQKHGQBZVLLOZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidines
Direct Parent pyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
    • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • secondary amine
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine