Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:24 UTC
Update Date2025-03-25 01:00:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241028
Frequency0.5
Structure
Chemical FormulaC5H10O2S
Molecular Mass134.0402
SMILESCC(C)=CC=[SH](=O)O
InChI KeyWLDIQVZLXBLBQM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioaldehydes
Direct Parent thioaldehyde s-oxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • thioaldehyde-s-oxide
  • hydrocarbon derivative