Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:28 UTC
Update Date2025-03-25 00:51:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188683
Frequency0.5
Structure
Chemical FormulaC9H12N2O
Molecular Mass164.095
SMILESCC(O)c1ccc(C(=N)N)cc1
InChI KeyFSHRRXABAPNETA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amidines
  • aromatic alcohols
  • carboximidamides
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • amidine
  • carboximidamide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound