| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:37 UTC |
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| Update Date | 2025-03-25 00:45:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150226 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H14N4O4 |
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| Molecular Mass | 278.1015 |
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| SMILES | CC1(C)OC2CC(n3cnc4c(=O)[nH]cnc43)OC2O1 |
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| InChI Key | HKKBPTVJLBAGPD-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 | hypoxanthines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dioxolanesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesketalslactamsn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspurines and purine derivativespyrimidonestetrahydrofuransvinylogous amides |
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| Substituents | meta-dioxolanelactampyrimidonepyrimidineorganic oxideacetalaromatic heteropolycyclic compoundimidazoleketalorganonitrogen compoundorganopnictogen compoundazolen-substituted imidazolevinylogous amideazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundhypoxanthinehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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