Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:08 UTC
Update Date2025-03-25 00:46:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153803
Frequency0.5
Structure
Chemical FormulaC11H16S
Molecular Mass180.0973
SMILESCSC(C)(C)Cc1ccccc1
InChI KeyRMYAGHPEKPDYQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • hydrocarbon derivative
  • organosulfur compound