| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:51 UTC |
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| Update Date | 2025-03-21 17:57:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00010468 |
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| Frequency | 449.7 |
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| Structure | |
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| Chemical Formula | C8H11N |
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| Molecular Mass | 121.0891 |
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| SMILES | Cc1ccc(C)c(C)n1 |
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| InChI Key | UTBIMNXEDGNJFE-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 | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspyridines and derivatives |
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| Substituents | aromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compound |
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