| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:27 UTC |
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| Update Date | 2025-03-25 00:53:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199998 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9N3O |
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| Molecular Mass | 163.0746 |
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| SMILES | Cn1cc(C=O)c2c1ncn2C |
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| InChI Key | LICUWJFEBVEAIN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl-aldehydes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesn-methylpyrrolesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundssubstituted pyrrolesvinylogous amides |
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| Substituents | vinylogous amiden-methylpyrroleazacycleheteroaromatic compoundsubstituted pyrroleorganic oxidearyl-aldehydearomatic heteropolycyclic compoundimidazolepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundazolen-substituted imidazole |
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