Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:50:52 UTC
Update Date2025-03-21 20:05:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00321550
Frequency6.0
Structure
Chemical FormulaC6H10OS
Molecular Mass130.0452
SMILESCC=C(C)C(=O)CS
InChI KeyULFDICCKWDXPKK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-branched alpha,beta-unsaturated ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • alkylthiols
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organosulfur compounds
  • Substituents
  • alpha-branched alpha,beta-unsaturated-ketone
  • aliphatic acyclic compound
  • organosulfur compound
  • ketone
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • alkylthiol
  • enone