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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:38 UTC
Update Date2025-03-25 00:53:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198091
Frequency0.5
Structure
Chemical FormulaC24H25N3O2
Molecular Mass387.1947
SMILESC=CC1=C(C)c2cc3[nH]c(cc4[nH]c(cc1n2)c(C)c4C)c(CCC(=O)O)c3C
InChI KeyWOBPSNYYPYBMAQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
    • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound