| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:36 UTC |
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| Update Date | 2025-03-25 00:46:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154902 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H18NO2+ |
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| Molecular Mass | 172.1332 |
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| SMILES | CC(=O)C(O)C1CCC[N+]1(C)C |
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| InChI Key | MCZWBKAKJIUVFP-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 | beta-amino ketones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acyloinsalpha-hydroxy ketonesaminesazacyclic compoundshydrocarbon derivativesn-alkylpyrrolidinesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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| Substituents | alpha-hydroxy ketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundorganic cationbeta-aminoketoneorganic saltpyrrolidineorganoheterocyclic compoundalcoholtetraalkylammonium saltazacyclen-alkylpyrrolidinequaternary ammonium saltacyloinsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamine |
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