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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:44 UTC
Update Date2025-03-21 18:38:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00121743
Frequency21.3
Structure
Chemical FormulaC17H17N4O8P
Molecular Mass436.0784
SMILESCc1cc2nc3c(=O)[nH]c(=O)nc-3n(C3OC(CO)C4OP(=O)(O)OC43)c2cc1C
InChI KeyLZILRLBTYOZAKP-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
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • dioxaphospholanes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organic phosphoric acids and derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrazines
  • pyrimidones
  • quinoxalines
  • tetrahydrofurans
  • Substituents
  • lactam
  • pyrimidone
  • flavin
  • pyrimidine
  • organic oxide
  • diazanaphthalene
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • alcohol
  • quinoxaline
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • 1,3_dioxaphospholane
  • oxacycle
  • organic oxygen compound
  • pyrazine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • organooxygen compound