Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:58 UTC
Update Date2025-03-25 00:46:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153429
Frequency0.5
Structure
Chemical FormulaC9H15NO5
Molecular Mass217.095
SMILESCC(=O)CCCCC(O)=NC(O)C(=O)O
InChI KeyFRPNVYPSORKEDF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • alpha hydroxy acids and derivatives
  • carboximidic acids
  • carboxylic acids
  • hydrocarbon derivatives
  • ketones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • organic 1,3-dipolar compound
  • hydroxy acid
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • alkanolamine