Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:51 UTC
Update Date2025-03-21 18:36:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00110005
Frequency24.3
Structure
Chemical FormulaC37H46N4O8
Molecular Mass674.3316
SMILESCOC(=O)CCc1c2[nH]c(c1C)Cc1[nH]c(c(C)c1CCC(=O)O)Cc1[nH]c(c(C)c1CCC(=O)O)Cc1[nH]c(c(C)c1CCC(=O)O)C2
InChI KeyOBAJUZAQUZWWJH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrapyrroles and derivatives
Subclass metallotetrapyrroles
Direct Parent metalloporphyrins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • fatty acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methyl esters
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • porphyrins
  • pyrroles
  • tetracarboxylic acids and derivatives
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • methyl ester
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • porphyrin
  • azacycle
  • heteroaromatic compound
  • tetracarboxylic acid or derivatives
  • fatty acid ester
  • organic oxygen compound
  • carboxylic acid ester
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • metalloporphyrin