| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:25 UTC |
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| Update Date | 2025-03-25 00:55:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211554 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17N5O7 |
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| Molecular Mass | 355.1128 |
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| SMILES | CC(=O)Nc1nc2c(c(=O)[nH]c(=O)n2C)n1C1OC(CO)C(O)C1O |
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| InChI Key | YUCRPWATOHQXDN-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 | acetamidesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsmonosaccharidesn-acetylarylaminesn-substituted imidazolesnucleoside and nucleotide analoguesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholspurinonespyrimidonessecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
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| Substituents | carbonyl grouplactamn-acetylarylaminemonosaccharidepyrimidonen-arylamideimidazopyrimidinecarboxylic acid derivativepurinonepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundprimary alcoholorganoheterocyclic compoundacetamideazolen-substituted imidazolealcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranpurine nucleosideheteroaromatic compoundcarboxamide groupoxacyclesecondary carboxylic acid amideorganic oxygen compoundsecondary alcoholhydrocarbon derivativepurineorganic nitrogen compoundorganooxygen compound |
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