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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:22:31 UTC
Update Date2025-03-24 16:48:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00968659
Frequency1.5
Structure
Chemical FormulaC52H64N6O11
Molecular Mass948.4633
SMILESCc1c2[nH]c(c1CO)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)Cc1[nH]c(c(CCC(=O)O)c1C)C2
InChI KeyKNXVEEUKJLLAMW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrapyrroles and derivatives
Subclass metallotetrapyrroles
Direct Parent metallotetrapyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pentacarboxylic acids and derivatives
  • pyrroles
    • Substituents
  • aromatic alcohol
  • alcohol
  • carbonyl group
  • carboxylic acid
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • pentacarboxylic acid or derivatives
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • metallotetrapyrrole skeleton
  • organooxygen compound