Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:39 UTC
Update Date2025-03-21 18:38:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119205
Frequency21.9
Structure
Chemical FormulaC9H16N4O3
Molecular Mass228.1222
SMILESNC(=O)CNC(=O)CNC(=O)C1CCCN1
InChI KeyVUHREDOUEQYEBL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic polymers
Classpolypeptides
Subclass polypeptides
Direct Parent polypeptides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acid amides
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • n-acyl-alpha amino acids
  • organic oxides
  • organopnictogen compounds
  • peptides
  • primary carboxylic acid amides
  • proline and derivatives
  • pyrrolidinecarboxamides
  • secondary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • amino acid or derivatives
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • alpha peptide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • n-acyl-alpha amino acid or derivatives
  • proline or derivatives
  • secondary aliphatic amine
  • polypeptide
  • alpha-amino acid amide
  • azacycle
  • n-acyl-alpha-amino acid
  • secondary amine
  • carboxamide group
  • n-substituted-alpha-amino acid
  • secondary carboxylic acid amide
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine-2-carboxamide
  • organooxygen compound
  • amine