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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:55:26 UTC
Update Date2025-03-25 01:14:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02328394
Frequency0.5
Structure
Chemical FormulaC30H48N4O24P2
Molecular Mass910.2134
SMILESCC(=O)NC1C(OP(=O)(O)OP(=O)(O)OCC2OC(N3C=CCC(C(N)=O)=C3)C(O)C2O)OC(COC2(C(=O)O)CC(O)C(NC(C)=O)C(C(O)C(O)CO)O2)C(O)C1O
InChI KeyYLCDBRLXZFRYJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpyridine nucleotides
Subclass nicotinamide nucleotides
Direct Parent nicotinamide nucleotides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • c-glucuronides
  • carbonyl compounds
  • carboxylic acids
  • dihydropyridines
  • enamines
  • hydrocarbon derivatives
  • ketals
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • monosaccharides
  • n-acyl-alpha-hexosamines
  • n-substituted nicotinamides
  • organic oxides
  • organic pyrophosphates
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • pentose phosphates
  • primary alcohols
  • primary carboxylic acid amides
  • pyran carboxylic acids
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
  • vinylogous amides
    • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • carboxylic acid
  • pentose phosphate
  • nicotinamide
  • monosaccharide
  • pentose-5-phosphate
  • nicotinamide-nucleotide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • n-acyl-alpha-hexosamine
  • saccharide
  • organic oxide
  • acetal
  • ketal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • dihydropyridine
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • acetamide
  • c-glucuronide
  • alcohol
  • vinylogous amide
  • pyran carboxylic acid or derivatives
  • azacycle
  • tetrahydrofuran
  • carboxamide group
  • organic pyrophosphate
  • n-substituted nicotinamide
  • oxacycle
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • pyran
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound
  • enamine