| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:43:34 UTC |
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| Update Date | 2025-03-25 01:33:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02440627 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H11NO2 |
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| Molecular Mass | 141.079 |
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| SMILES | CC(=O)C1CN(C)CC1=O |
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| InChI Key | AUPBKUMVPUGMFA-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-diketones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsbeta-amino ketonescyclic ketonesgamma-amino ketoneshydrocarbon derivativesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundspyrrolidine-3-onestrialkylamines |
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| Substituents | 3-pyrrolidonecyclic ketoneketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundbeta-aminoketonepyrrolidinepyrrolidonetertiary amineorganoheterocyclic compoundgamma-aminoketoneazacyclen-alkylpyrrolidinetertiary aliphatic aminehydrocarbon derivativeorganic nitrogen compoundamine1,3-diketone |
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