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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:11 UTC
Update Date2025-03-25 00:45:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149196
Frequency0.5
Structure
Chemical FormulaC42H81NO4
Molecular Mass663.6166
SMILESCCCCCCCCCCCCCC=CC(O)C(NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)C(=O)O
InChI KeyDLJFDSXBXYNMOE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsphingolipids
Subclass ceramides
Direct Parent long-chain ceramides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • amino fatty acids
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • long-chain fatty acids
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-acyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • fatty amide
  • long-chain ceramide
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydroxy fatty acid
  • n-acyl-alpha amino acid or derivatives
  • alcohol
  • n-acyl-alpha-amino acid
  • hydroxy acid
  • carboxamide group
  • amino fatty acid
  • n-acyl-amine
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound