Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:23 UTC
Update Date2025-03-25 00:57:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02223057
Frequency0.5
Structure
Chemical FormulaC6H10N2O4
Molecular Mass174.0641
SMILESNC(CCCC(=O)C(=O)O)N=O
InChI KeyLVZQKQVNUXNDKG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass medium-chain keto acids and derivatives
Direct Parent medium-chain keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • amino fatty acids
  • c-nitroso compounds
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • alpha-keto acid
  • organopnictogen compound
  • organic nitroso compound
  • organic 1,3-dipolar compound
  • amino fatty acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • c-nitroso compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • medium-chain keto acid