Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:30:35 UTC
Update Date2025-03-25 00:19:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01277403
Frequency1.0
Structure
Chemical FormulaC6H12OS
Molecular Mass132.0609
SMILESCCCC(C=O)=[SH]C
InChI KeySPCSUNQEFNVXDV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioketones
Direct Parent thioketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • alkylthiols
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • thioketone
  • aldehyde
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound