| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:07 UTC |
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| Update Date | 2025-03-21 18:02:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038821 |
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| Frequency | 97.5 |
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| Structure | |
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| Chemical Formula | C6H7N5O |
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| Molecular Mass | 165.0651 |
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| SMILES | COc1nc(N)c2[nH]cnc2n1 |
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| InChI Key | TUDKBZAMOFJOSO-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 | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | purines and purine derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | etherazacycleheteroaromatic compoundalkyl aryl etherpyrimidineorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundimidolactamamineorganooxygen compoundazole |
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