Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:03:52 UTC
Update Date2025-03-24 19:52:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01066419
Frequency1.3
Structure
Chemical FormulaC5H12S
Molecular Mass104.066
SMILESC[SH]=CC(C)C
InChI KeyPBIGEKKZMPLITL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioaldehydes
Direct Parent thioaldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • thioaldehyde
  • hydrocarbon derivative
  • alkylthiol