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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:32 UTC
Update Date2025-03-21 18:41:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00133013
Frequency19.0
Structure
Chemical FormulaC15H26N4O4S2
Molecular Mass390.1395
SMILESNC(CCCCNC(=O)CCCCC1SSC2NC(=O)NC12)C(=O)O
InChI KeyBLGWPQITYKZDPL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdithiolanes
Subclass lipoamides
Direct Parent lipoamides
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-dithiolanes
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • imidazolidinones
  • medium-chain fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • organic carbonic acids and derivatives
  • organic disulfides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • imidazolidine
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • heterocyclic fatty acid
  • fatty amide
  • fatty acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • 1,2-dithiolane
  • aliphatic heteropolycyclic compound
  • imidazolidinone
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • medium-chain fatty acid
  • carbonic acid derivative
  • azacycle
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organic disulfide
  • lipoamide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound