Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:14:08 UTC |
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Update Date | 2025-03-21 18:33:28 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00095928 |
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Frequency | 28.9 |
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Structure | |
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Chemical Formula | C13H17N4+ |
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Molecular Mass | 229.1448 |
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SMILES | Cc1ncc(C[n+]2ccc(C)c(C)c2)c(N)n1 |
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InChI Key | DONPPIVOGFMYFT-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 | pyridines and derivatives |
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Subclass | halopyridines |
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Direct Parent | polyhalopyridines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmethylpyridinesorganic cationsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivatives |
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Substituents | aromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundmethylpyridinepyrimidineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic cationimidolactamamine |
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