Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:24 UTC
Update Date2025-03-25 00:46:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154461
Frequency0.5
Structure
Chemical FormulaC18H29N5O6
Molecular Mass411.2118
SMILESCC(=O)NC(C(=O)NC(Cc1cnc[nH]1)C(=O)NC(CC(C)C)C(=O)O)C(C)O
InChI KeyQQEGFWPKYKZWLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic polymers
Classpolypeptides
Subclass polypeptides
Direct Parent polypeptides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • alpha amino acid amides
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • leucine and derivatives
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-acyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • peptides
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • fatty amide
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • alpha peptide
  • organic oxide
  • imidazole
  • leucine or derivatives
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • acetamide
  • azole
  • n-acyl-alpha amino acid or derivatives
  • alcohol
  • polypeptide
  • alpha-amino acid amide
  • azacycle
  • n-acyl-alpha-amino acid
  • heteroaromatic compound
  • carboxamide group
  • n-acyl-amine
  • n-substituted-alpha-amino acid
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound