Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:07 UTC
Update Date2025-03-25 01:00:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245038
Frequency0.5
Structure
Chemical FormulaC11H16N2O
Molecular Mass192.1263
SMILESCN=C(CC(O)c1ccccc1)NC
InChI KeyGCXFGXBINANGKF-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
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound