| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:50 UTC |
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| Update Date | 2025-03-21 18:42:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00138272 |
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| Frequency | 18.0 |
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| Structure | |
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| Chemical Formula | C7H8NO+ |
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| Molecular Mass | 122.06 |
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| SMILES | CC(=O)[n+]1ccccc1 |
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| InChI Key | NEPUSMMANAIXNX-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 | methylpyridines |
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| Direct Parent | methylpyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundmethylpyridineorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationacetamideorganooxygen compound |
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