Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:21 UTC
Update Date2025-03-21 18:04:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00051273
Frequency79.3
Structure
Chemical FormulaC12H20N4O
Molecular Mass236.1637
SMILESCN(C)C(=N)NCCCC(O)c1cccnc1
InChI KeyNHLYQSKLEHYJIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydroxypyridines
Direct Parent hydroxypyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • carboximidamides
  • guanidines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imines
  • methylpyridines
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • guanidine
  • imine
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • carboximidamide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound