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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:35:27 UTC
Update Date2025-03-24 21:42:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01861747
Frequency0.7
Structure
Chemical FormulaC61H77N7O13
Molecular Mass1115.5579
SMILESCCC1C(Cc2[nH]c(Cc3c4[nH]c(c3CCC(=O)O)Cc3[nH]c(c(C)c3CCC(=O)O)Cc3[nH]c(c(C)c3CCC(=O)O)Cc3[nH]c(c(C)c3CCC(=O)O)Cc3[nH]c(c(C)c3CCC(=O)O)C4)c(CCC(=O)O)c2C)NC(=O)C1C
InChI KeyHHPBALPMCLNQMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrapyrroles and derivatives
Subclass metallotetrapyrroles
Direct Parent metallotetrapyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hexacarboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • pyrrolidine-2-ones
  • secondary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • metallotetrapyrrole skeleton
  • hexacarboxylic acid or derivatives
  • pyrrolidine
  • pyrrolidone
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound