| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:38 UTC |
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| Update Date | 2025-03-25 00:54:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02207251 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H14N4O7 |
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| Molecular Mass | 326.0862 |
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| SMILES | Nc1nc(=O)n(C2OC(CO)C(O)C2O)c2[nH]c(C(=O)O)cc12 |
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| InChI Key | MQNQXOQRFVUKEF-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidinecarboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonocarboxylic acids and derivativesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminespyrimidonespyrrole 2-carboxylic acidspyrrole carboxylic acids and derivativespyrrolo[2,3-d]pyrimidinessecondary alcoholstetrahydrofurans |
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| Substituents | carboxylic acidamino acid or derivativesamino acidmonosaccharidepyrimidonecarboxylic acid derivativepyrrolopyrimidinesaccharideorganic oxidepyrrolo[2,3-d]pyrimidinepyrrole-2-carboxylic acidpyrrole-2-carboxylic acid or derivativesaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholimidolactampyrimidine-6-carboxylic acidalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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