Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:14 UTC
Update Date2025-03-25 00:54:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208673
Frequency0.5
Structure
Chemical FormulaC41H40N4O15
Molecular Mass828.249
SMILESCC(=O)c1c(CCC(=O)O)c2cc3nc(cc4[nH]c(cc5nc(cc1[nH]2)C(CCC(=O)O)=C5CC(=O)O)c(CCC(=O)O)c4CCC(=O)O)C(CC(=O)O)=C3CCC(=O)O
InChI KeyPRCHAODBEWMRPH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrapyrroles and derivatives
Subclass metallotetrapyrroles
Direct Parent metallotetrapyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • azacyclic compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • carboxylic acid
  • aryl alkyl ketone
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • metallotetrapyrrole skeleton
  • organooxygen compound
  • aryl ketone