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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:52:44 UTC
Update Date2025-03-21 22:59:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00610696
Frequency2.6
Structure
Chemical FormulaC10H11N
Molecular Mass145.0891
SMILESC=CCN=Cc1ccccc1
InChI KeyGXFNRLVWKGAVGK-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
  • aldimines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aromatic homomonocyclic compound
  • aldimine
  • monocyclic benzene moiety
  • imine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • organic nitrogen compound
  • propargyl-type 1,3-dipolar organic compound