Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:17 UTC
Update Date2025-03-25 00:48:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169936
Frequency0.5
Structure
Chemical FormulaC11H13NO3
Molecular Mass207.0895
SMILESCCOC(=O)N1COc2ccccc2C1
InChI KeyRCQOPQRCUYGUCA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxazines
Subclass benzoxazines
Direct Parent benzoxazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • carbamate esters
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • carbamic acid ester
  • benzoxazine
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound