Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:28:46 UTC
Update Date2025-03-25 01:04:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02267060
Frequency0.5
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESC=CC(=O)CCCCS
InChI KeyOXRNVVDGCUTQJW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass acryloyl compounds
Direct Parent acryloyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alpha,beta-unsaturated ketone
  • organosulfur compound
  • ketone
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • alkylthiol
  • enone