| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:29:21 UTC |
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| Update Date | 2025-03-21 23:18:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00696631 |
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| Frequency | 2.2 |
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| Structure | |
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| Chemical Formula | C6H13N2+ |
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| Molecular Mass | 113.1073 |
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| SMILES | CC(C#N)[N+](C)(C)C |
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| InChI Key | AVLKCUIVPKOUPA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | quaternary ammonium salts |
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| Direct Parent | tetraalkylammonium salts |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha-aminonitrilesamineshydrocarbon derivativesorganic cationsorganic saltsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundnitriletetraalkylammonium saltorganopnictogen compoundhydrocarbon derivativeorganic cationalpha-aminonitrileorganic saltaminecarbonitrile |
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