| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:21:06 UTC |
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| Update Date | 2025-03-25 00:15:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01254897 |
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| Frequency | 1.1 |
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| Structure | |
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| Chemical Formula | C7H7NO2+ |
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| Molecular Mass | 137.0471 |
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| SMILES | CC1=[N+]C=C(C(=O)O)C=C1 |
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| InChI Key | IIOFYKCVQNDXLP-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesketiminesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganopnictogen compounds |
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| Substituents | ketiminecarbonyl groupcarboxylic acidazacycleiminemethylpyridinecarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganooxygen compound |
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