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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:38 UTC
Update Date2025-03-25 00:50:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179932
Frequency0.5
Structure
Chemical FormulaC47H57N5O10
Molecular Mass851.4105
SMILESCc1c(CCC(=O)O)cc2nc1CCc1[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 KeyHTJNYBZKGMPJND-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrapyrroles and derivatives
Subclass metallotetrapyrroles
Direct Parent metallotetrapyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pentacarboxylic acids and derivatives
  • polyhalopyridines
  • pyrroles
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • carboxylic acid derivative
  • pentacarboxylic acid or derivatives
  • organic oxide
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • metallotetrapyrrole skeleton
  • organooxygen compound