Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:06 UTC
Update Date2025-03-25 00:49:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171826
Frequency0.5
Structure
Chemical FormulaC12H19N3O2
Molecular Mass237.1477
SMILESCN(C)CC(CNC(N)=O)c1ccc(O)cc1
InChI KeyMSHYVPAPJOEMHW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carbonic acid derivative
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound