| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:22 UTC |
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| Update Date | 2025-03-21 18:07:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00067831 |
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| Frequency | 44.7 |
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| Structure | |
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| Chemical Formula | C11H19N4O8P |
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| Molecular Mass | 366.094 |
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| SMILES | NC(=O)C(N)Cc1cn(C2OC(COP(=O)(O)O)C(O)C2O)cn1 |
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| InChI Key | CVVWPELOFVNFSX-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 heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesfatty amidesheteroaromatic compoundshydrocarbon derivativesimidazole ribonucleosides and ribonucleotidesimidazolesmonoalkyl phosphatesmonoalkylaminesmonosaccharidesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary carboxylic acid amidessecondary alcoholstetrahydrofurans |
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| Substituents | primary carboxylic acid amidefatty acylimidazole ribonucleosidecarbonyl grouparomatic heteromonocyclic compoundpentose phosphatefatty amidepentose-5-phosphatealpha-amino acid or derivativescarboxylic acid derivativeorganic oxideimidazoleorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazole1,2-dioln-substituted imidazolealcoholazacycletetrahydrofuranheteroaromatic compoundcarboxamide groupoxacyclephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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