Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:16 UTC
Update Date2025-03-21 18:35:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106075
Frequency25.4
Structure
Chemical FormulaC11H10S
Molecular Mass174.0503
SMILESCSc1cccc2ccccc12
InChI KeyDKICYCNWKRHPFR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alkylarylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • thiophenol ethers
  • thiophenols
  • Substituents
  • thiophenol
  • naphthalene
  • sulfenyl compound
  • thioether
  • thiophenol ether
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether