Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:34:30 UTC
Update Date2025-03-21 17:56:38 UTC
HMDB IDHMDB0012289
Metabolite Identification
DeepMet IDDMID00002645
NameTetrahydrodipicolinate
Frequency2275.9
Structure
Chemical FormulaC7H9NO4
Molecular Mass171.0532
SMILESO=C(O)C1=NC(C(=O)O)CCC1
InChI KeyCXMBCXQHOXUCEO-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 heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketimines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • tetrahydropyridines
  • Substituents
  • ketimine
  • carbonyl group
  • carboxylic acid
  • azacycle
  • imine
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound