Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:36:49 UTC
Update Date2025-03-24 22:08:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02006943
Frequency0.6
Structure
Chemical FormulaC8H9NO
Molecular Mass135.0684
SMILESc1ccc2c(c1)CCNO2
InChI KeyBGDOLELXXPTPFX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxazines
Subclass benzoxazines
Direct Parent benzoxazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • n-organohydroxylamines
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • azacycle
  • benzoxazine
  • n-organohydroxylamine
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound