Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:18 UTC
Update Date2025-03-25 00:58:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229428
Frequency0.5
Structure
Chemical FormulaC20H38OS
Molecular Mass326.2643
SMILESCCCCCCCCCCCCCCCC(=O)C1CCCS1
InChI KeyNYLQTGWZCLLVCS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolanes
Subclass thiolanes
Direct Parent thiolanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • thiolane
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • thioether
  • dialkylthioether
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound