Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:51 UTC
Update Date2025-03-25 00:54:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205497
Frequency0.5
Structure
Chemical FormulaC14H15NO3
Molecular Mass245.1052
SMILESNCCc1cccc(O)c1Oc1ccc(O)cc1
InChI KeyGSCHACBESKWHIU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • diarylethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • diaryl ether
  • phenol ether
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • phenoxy compound
  • diphenylether
  • organooxygen compound