| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:35 UTC |
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| Update Date | 2025-03-21 18:02:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039915 |
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| Frequency | 86.9 |
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| Structure | |
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| Chemical Formula | C6H6N4O3 |
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| Molecular Mass | 182.044 |
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| SMILES | Cn1[nH]c(=O)c2[nH]c(=O)[nH]c2c1=O |
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| InChI Key | NCPYXPQBRHHIEC-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 | diazines |
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| Subclass | pyridazines and derivatives |
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| Direct Parent | pyridazinones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidecarbonic acid derivativelactamazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepyridazinoneorganic nitrogen compoundorganooxygen compoundazole |
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