Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:45:30 UTC
Update Date2025-03-24 21:19:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01743549
Frequency0.7
Structure
Chemical FormulaC10H11N
Molecular Mass145.0891
SMILESCN=CC=Cc1ccccc1
InChI KeyNJGHGGHJBZLVKF-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