Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:48:33 UTC
Update Date2025-03-21 18:51:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00177786
Frequency13.0
Structure
Chemical FormulaC6H10N2
Molecular Mass110.0844
SMILESNCCn1cccc1
InChI KeyHPDIRFBJYSOVKW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • substituted pyrrole
  • primary aliphatic amine
  • organic nitrogen compound