| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:44 UTC |
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| Update Date | 2025-03-21 18:01:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00033096 |
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| Frequency | 115.4 |
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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 | Cn1c(=O)[nH]c2c(=O)[nH][nH]c(=O)c21 |
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| InChI Key | VJHWSBTYTLTCAA-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 derivativesimidazoleslactamsn-substituted imidazolesorganic 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 compoundazolen-substituted imidazole |
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