Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:32 UTC
Update Date2025-03-25 00:47:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161384
Frequency0.5
Structure
Chemical FormulaC6H15N3OS2
Molecular Mass209.0657
SMILESNCCCSSCC(N)C(N)=O
InChI KeyMELAXIPPUJLIOX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent cysteine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyldisulfides
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • sulfenyl compounds
  • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • organosulfur compound
  • carboxamide group
  • dialkyldisulfide
  • organic oxide
  • organic oxygen compound
  • organic disulfide
  • cysteine or derivatives
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound