Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:04:27 UTC
Update Date2025-03-21 22:08:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00495921
Frequency3.5
Structure
Chemical FormulaC8H11O+
Molecular Mass123.0804
SMILESCCc1ccc(C)[o+]c1
InChI KeyDAOLDKBIZLHGGI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic cations
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • aromatic heteromonocyclic compound
  • organic oxygen compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • organic cation
  • organooxygen compound