| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:34:22 UTC |
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| Update Date | 2025-03-24 17:52:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00996957 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C7H7NO+ |
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| Molecular Mass | 121.0522 |
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| SMILES | CC(=O)C1=CC=C[N+]=C1 |
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| InChI Key | DIZTZXJMHVGNNC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | ketones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundshydrocarbon derivativesiminesorganic cationsorganic oxidesorganopnictogen compounds |
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| Substituents | azacycleimineketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganoheterocyclic compound |
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