Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:14:30 UTC
Update Date2025-03-21 20:51:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00376989
Frequency4.9
Structure
Chemical FormulaC7H8N2O
Molecular Mass136.0637
SMILESOCc1c[nH]c2cc[nH]c12
InChI KeyNTXBEGHHCPEPPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound