| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:52 UTC |
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| Update Date | 2025-03-25 00:54:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02207815 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H20N6O7 |
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| Molecular Mass | 384.1393 |
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| SMILES | Nc1ncnc2c1ncn2CC(O)C(O)C1OC(O)(C(=O)O)CC(O)C1N |
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| InChI Key | VATQKAZIYXADIE-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 | c-glucuronides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativesamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdelta amino acids and derivativeshemiacetalsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsmonoalkylaminesmonocarboxylic acids and derivativesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanespurines and purine derivativespyran carboxylic acidspyrimidines and pyrimidine derivativessecondary alcohols |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidalpha-hydroxy acidimidazopyrimidinecarboxylic acid derivativepyran carboxylic acidpyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhemiacetaldelta amino acid or derivativesoxaneimidolactamorganoheterocyclic compoundazolen-substituted imidazolec-glucuronidealcoholpyran carboxylic acid or derivativesazacycleheteroaromatic compoundhydroxy acidoxacyclemonocarboxylic acid or derivativespyransecondary alcoholhydrocarbon derivativeprimary aliphatic amineprimary aminepurineorganic nitrogen compoundamine |
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