Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:43:23 UTC
Update Date2025-03-24 14:01:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00730707
Frequency2.1
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCC1NCCc2cc[nH]c21
InChI KeySTFHWKZGWSCAGE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine