| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:56:12 UTC |
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| Update Date | 2025-03-21 18:04:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00053228 |
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| Frequency | 72.6 |
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| Structure | |
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| Chemical Formula | C9H11N5O5 |
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| Molecular Mass | 269.076 |
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| SMILES | OCC1OC(n2cnc3nnc(O)nc32)C(O)C1O |
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| InChI Key | CIOKCIXQNIVUJX-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 | triazines |
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| Subclass | 1,2,4-triazines |
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| Direct Parent | 1,2,4-triazines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesmonosaccharidesn-substituted imidazolesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholazacycletetrahydrofuranheteroaromatic compoundmonosaccharideoxacyclesaccharideorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcohol1,2,4-triazineorganooxygen compoundazolen-substituted imidazole |
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