| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:17 UTC |
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| Update Date | 2025-03-21 18:32:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00089070 |
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| Frequency | 31.7 |
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| Structure | |
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| Chemical Formula | C10H14N3O7P |
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| Molecular Mass | 319.0569 |
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| SMILES | Cn1c(=N)ccn(C2OC3COP(=O)(O)OC3C2O)c1=O |
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| InChI Key | MQQXIPWKQWIRJF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | pentose phosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonosaccharidesorganic oxidesorganic phosphoric acids and derivativesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrimidonessecondary alcoholstetrahydrofuransureas |
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| Substituents | pentose phosphatepyrimidonepyrimidineureaorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundimidolactamorganoheterocyclic compoundalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacyclesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivative |
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