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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:36 UTC
Update Date2025-03-25 00:46:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154915
Frequency0.5
Structure
Chemical FormulaC24H32N4O12
Molecular Mass568.2017
SMILESCc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C(O)CO)c2cc1C
InChI KeyPABDFBOENQBHDL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass alloxazines and isoalloxazines
Direct Parent flavins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • alkyl glycosides
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • fatty acyl glycosides of mono- and disaccharides
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • pyrazines
  • pyrimidones
  • quinoxalines
  • secondary alcohols
  • Substituents
  • fatty acyl
  • fatty acyl glycoside of mono- or disaccharide
  • lactam
  • monosaccharide
  • pyrimidone
  • flavin
  • pyrimidine
  • saccharide
  • organic oxide
  • acetal
  • diazanaphthalene
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • alcohol
  • quinoxaline
  • carbonic acid derivative
  • fatty acyl glycoside
  • azacycle
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • pyrazine
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • alkyl glycoside