Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:26 UTC
Update Date2025-03-21 18:40:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00128079
Frequency19.9
Structure
Chemical FormulaC7H10OS
Molecular Mass142.0452
SMILESCCSc1ccc(C)o1
InChI KeyNYGVCCYPLJRCQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioethers
Subclass aryl thioethers
Direct Parent aryl thioethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkylarylthioethers
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • Substituents
  • furan
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • alkylarylthioether
  • aryl thioether
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound