Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:34:47 UTC
Update Date2025-03-24 22:08:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02002062
Frequency0.6
Structure
Chemical FormulaC46H91NO22P4
Molecular Mass1133.4983
SMILESCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(NC(=O)CC(O)CCCCCCCCCCC)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O
InChI KeyQBHWHUCWHZILBB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • cyclitols and derivatives
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • fatty amide
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • alcohol
  • cyclitol or derivatives
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • fatty acid ester
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound