Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:26 UTC
Update Date2025-03-25 00:48:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165730
Frequency0.5
Structure
Chemical FormulaC10H16N2O4S
Molecular Mass260.0831
SMILESCC=CCCCC(O)=NC(CSN=O)C(=O)O
InChI KeyZLXUWYLQHDNKEO-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
  • carboximidic acids
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • nitrosothiols
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • carbonyl group
  • carboxylic acid
  • organosulfur compound
  • nitrosothiol
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organic s-nitroso compound
  • organic nitroso compound
  • sulfenyl compound
  • organic 1,3-dipolar compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • cysteine or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • nitrosothiol-group