Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:20:24 UTC
Update Date2025-03-24 16:47:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00963654
Frequency1.5
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESCC(N)C(O)c1cc[nH]c1
InChI KeyDLFXYNSVLPWKNR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound