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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:44:26 UTC
Update Date2025-03-25 01:10:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02302834
Frequency0.5
Structure
Chemical FormulaC40H76N3O15P
Molecular Mass869.5014
SMILESCCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)O)OC(OC(=O)NCCCCC(N)C(=O)O)C(O)C1OC(=O)CC(O)CCCCCCCCCCC
InChI KeyYCHNCLWEMMPKJT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • beta hydroxy acids and derivatives
  • carbamate esters
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acid esters
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • medium-chain fatty acids
  • medium-chain hydroxy acids and derivatives
  • monoalkyl phosphates
  • monoalkylamines
  • monosaccharides
  • n-acyl amines
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • monosaccharide
  • medium-chain hydroxy acid
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • medium-chain fatty acid
  • hydroxy fatty acid
  • oxane
  • organoheterocyclic compound
  • alcohol
  • carbonic acid derivative
  • carbamic acid ester
  • hydroxy acid
  • carboxamide group
  • n-acyl-amine
  • oxacycle
  • secondary carboxylic acid amide
  • fatty acid ester
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound