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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:48 UTC
Update Date2025-03-21 18:35:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107416
Frequency25.0
Structure
Chemical FormulaC44H55N5O9
Molecular Mass797.4
SMILESCc1c2[nH]c(c1CCO)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(CCC(=O)O)c1C)Cc1[nH]c(c(CCC(=O)O)c1C)C2
InChI KeyDGLIUAWMKBAMOY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrapyrroles and derivatives
Subclass metallotetrapyrroles
Direct Parent metallotetrapyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alcohols and polyols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • tetracarboxylic acids and derivatives
    • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • azacycle
  • heteroaromatic compound
  • tetracarboxylic acid or derivatives
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • metallotetrapyrrole skeleton
  • organooxygen compound