| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:42 UTC |
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| Update Date | 2025-03-21 18:29:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00078278 |
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| Frequency | 45.4 |
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| Structure | |
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| Chemical Formula | C12H13N3O7 |
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| Molecular Mass | 311.0754 |
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| SMILES | O=C(O)c1cn(C2OC(CO)C(O)C2O)c2[nH]cnc(=O)c12 |
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| InChI Key | LQXDVFNMJJJMGK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | nucleosides, nucleotides, and analogues |
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| Class | pyrrolopyrimidine nucleosides and nucleotides |
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| Subclass | pyrrolopyrimidine nucleosides and nucleotides |
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| Direct Parent | pyrrolopyrimidine nucleosides and nucleotides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compoundsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrimidinecarboxylic acidspyrimidonespyrrole carboxylic acidspyrrolo[2,3-d]pyrimidinessecondary alcoholssubstituted pyrrolestetrahydrofuransvinylogous amides |
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| Substituents | carboxylic acidpyrrole-3-carboxylic acid or derivativesmonosaccharidepyrimidonesubstituted pyrrolecarboxylic acid derivativepyrimidinepyrrolopyrimidinesaccharideorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundprimary alcoholorganoheterocyclic compoundalcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundpyrimidine-5-carboxylic acidpyrrolopyrimidine ribonucleosideoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundpyrrole-3-carboxylic acidorganooxygen compound |
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