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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:06:50 UTC
Update Date2025-03-24 19:54:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01073297
Frequency1.3
Structure
Chemical FormulaC47H55N11O9S2
Molecular Mass981.3626
SMILESNC1CSSCC2CCCN2C(=O)C(Cc2cnc[nH]2)NC(=O)C(Cc2cnc[nH]2)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(Cc2ccc(O)cc2)NC1=O
InChI KeyQGVICWNMCDTSQD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic polymers
Classpolypeptides
Subclass polypeptides
Direct Parent polypeptides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alpha amino acids
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • cyclic peptides
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • macrolactams
  • monoalkylamines
  • organic disulfides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • secondary carboxylic acid amides
  • tertiary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • 1-hydroxy-2-unsubstituted benzenoid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • macrolactam
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • azole
  • polypeptide
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • cyclic alpha peptide
  • organic disulfide
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound