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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:02:35 UTC
Update Date2025-03-24 21:00:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01639890
Frequency0.8
Structure
Chemical FormulaC103H192N2O34P2
Molecular Mass2063.2832
SMILESCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)OC1C(NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)C(OCC2OC(OP(=O)(O)O)C(NC(=O)CC(O)CCCCCCCCCCC)C(OC(=O)CC(O)CCCCCCCCCCC)C2O)OC(COC2(C(=O)O)OC(C(O)CO)C(C(O)C(O)CO)O2)C1OP(=O)(O)O
InChI KeyIIDLUSDZQHTFBQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent acylaminosugars
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • acetals
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acid orthoesters
  • carboxylic acids
  • fatty acid esters
  • hexose phosphates
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monosaccharides
  • n-acyl amines
  • n-acyl-alpha-hexosamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • ortho esters
  • oxacyclic compounds
  • oxanes
  • pentacarboxylic acids and derivatives
  • primary alcohols
  • saccharolipids
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • fatty acyl
  • meta-dioxolane
  • carbonyl group
  • carboxylic acid
  • ortho ester
  • fatty amide
  • monosaccharide
  • carboxylic acid orthoester
  • carboxylic acid derivative
  • n-acyl-alpha-hexosamine
  • beta-hydroxy acid
  • organic oxide
  • acetal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • orthocarboxylic acid derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • hydroxy acid
  • carboxamide group
  • pentacarboxylic acid or derivatives
  • n-acyl-amine
  • acylaminosugar
  • oxacycle
  • secondary carboxylic acid amide
  • fatty acid ester
  • phosphoric acid ester
  • monoalkyl phosphate
  • carboxylic acid ester
  • hexose phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • saccharolipid
  • organic phosphoric acid derivative
  • alkyl phosphate