Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:36 UTC
Update Date2025-03-21 18:39:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123718
Frequency20.8
Structure
Chemical FormulaC9H15N3O
Molecular Mass181.1215
SMILESCN(C)CCC(O)c1cnccn1
InChI KeyGUPBYRBDPJDPTF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrazines
Direct Parent pyrazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • alcohol
  • 1,3-aminoalcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organic oxygen compound
  • pyrazine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound