| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:48 UTC |
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| Update Date | 2025-03-25 00:47:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159767 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H12N4O9S |
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| Molecular Mass | 364.0325 |
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| SMILES | O=c1nc(O)c2nc(O)[nH]c2n1C1OC(CS(=O)(=O)O)C(O)C1O |
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| InChI Key | MEUSENKAFYHETQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | xanthines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-diolsalkaloids and derivativesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyrimidinesimidazolesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonic acidsoxacyclic compoundspurinonespyrimidonessecondary alcoholssulfonylstetrahydrofurans |
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| Substituents | organosulfonic acid or derivativesorganosulfonic acidmonosaccharidepyrimidonehydroxypyrimidineorganosulfur compoundpurinonepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazole1,2-diolalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundxanthineoxacyclealkaloid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativessecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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