Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:30:41 UTC
Update Date2025-03-24 21:40:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01850190
Frequency0.7
Structure
Chemical FormulaC6H12N2S
Molecular Mass144.0721
SMILESNCCCCc1c[nH]s1
InChI KeyUQRKLWCCYNWKJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound