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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:54 UTC
Update Date2025-03-21 18:37:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114967
Frequency22.9
Structure
Chemical FormulaC5H11NO9P+
Molecular Mass260.0166
SMILESO=[N+](O)C1OC(COP(=O)(O)O)C(O)C1O
InChI KeyMCNVKBJOVVAQSD-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent pentose phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • c-nitro compounds
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monosaccharides
  • organic oxides
  • organic oxoanionic compounds
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • pentose phosphate
  • allyl-type 1,3-dipolar organic compound
  • pentose-5-phosphate
  • organic nitro compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • c-nitro compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organic oxoazanium
  • organoheterocyclic compound
  • 1,2-diol
  • alcohol
  • tetrahydrofuran
  • organic 1,3-dipolar compound
  • oxacycle
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organic hyponitrite