| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:15 UTC |
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| Update Date | 2025-03-25 00:47:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160721 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15N5O7 |
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| Molecular Mass | 329.0971 |
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| SMILES | Nc1nc2c(c(=O)[nH]1)N(C1OC(CO)C(O)C1O)C(C(=O)O)N2 |
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| InChI Key | VFIIECJEGHSARU-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 | purine nucleosides |
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| Subclass | purine nucleosides |
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| Direct Parent | purine nucleosides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylarylaminesheteroaromatic compoundshydrocarbon derivativesimidolactamslactamsmonocarboxylic acids and derivativesmonosaccharidesnucleoside and nucleotide analoguesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminespurinonespyrimidonessecondary alcoholssecondary alkylarylaminestetrahydrofuransvinylogous amides |
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| Substituents | carbonyl grouplactamcarboxylic acidamino acid or derivativesamino acidmonosaccharidepyrimidonealpha-amino acid or derivativesimidazopyrimidinecarboxylic acid derivativepurinonepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddialkylarylamineprimary alcoholimidolactamorganoheterocyclic compoundalcoholvinylogous amideazacycletetrahydrofuranpurine nucleosideheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic amineoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativepurineprimary amineorganic nitrogen compoundamineorganooxygen compound |
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