Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:17 UTC
Update Date2025-03-25 00:56:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220521
Frequency0.5
Structure
Chemical FormulaC9H15NO8
Molecular Mass265.0798
SMILESO=C(O)CNC1(C(=O)O)CC(O)C(O)C(O)C1O
InChI KeyJIRLCXAACWCUSJ-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 homomonocyclic compounds
Alternative Parents
  • amino acids
  • aminosaccharides
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclitols and derivatives
  • cyclohexanols
  • dialkylamines
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • beta-hydroxy acid
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alcohol
  • amino saccharide
  • secondary aliphatic amine
  • cyclohexanol
  • cyclitol or derivatives
  • hydroxy acid
  • cyclic alcohol
  • secondary amine
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine