Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:10:52 UTC
Update Date2025-03-25 01:44:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02504485
Frequency0.5
Structure
Chemical FormulaC7H10NO+
Molecular Mass124.0757
SMILESCCc1cc(C)[o+]cn1
InChI KeyKRWFVJJSESTWHV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic cations
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound