Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:44 UTC
Update Date2025-03-21 18:38:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119386
Frequency21.8
Structure
Chemical FormulaC8H15NO3S2
Molecular Mass237.0493
SMILESNC(=O)CCCCC1CCS(=O)(=O)S1
InChI KeyUAWZANFRPUBGMD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdithiolanes
Subclass lipoamides
Direct Parent lipoamides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-dithiolanes
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • carbonyl group
  • fatty amide
  • carboxamide group
  • carboxylic acid derivative
  • 1,2-dithiolane
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • lipoamide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound