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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:09:32 UTC
Update Date2025-03-24 22:31:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01226637
Frequency1.1
Structure
Chemical FormulaC48H92NO13P
Molecular Mass921.6306
SMILESCCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)O)CC(O)C(OC(=O)CC(O)CCCCCCCCCCC)C1OC(=O)CC(O)CCCCCCCCCCC
InChI KeyZHBYBWITLNYOOC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • cyclitols and derivatives
  • dicarboxylic acids and derivatives
  • fatty acid esters
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • carbonyl group
  • fatty amide
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • cyclohexanol
  • cyclitol or derivatives
  • hydroxy acid
  • cyclic alcohol
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • fatty acid ester
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate