| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:45:49 UTC |
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| Update Date | 2025-03-21 18:00:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00028575 |
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| Frequency | 131.6 |
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| Structure | |
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| Chemical Formula | C11H14N2O2 |
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| Molecular Mass | 206.1055 |
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| SMILES | CN(CCCC(=O)c1ccccc1)N=O |
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| InChI Key | RLSFBEWITNZQIE-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 | alkyl-phenylketones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl alkyl ketonesbenzoyl derivativesbutyrophenoneshydrocarbon derivativesorganic n-nitroso compoundsorganic oxidesorganooxygen compoundsorganopnictogen compoundsphenylbutylamines |
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| Substituents | monocyclic benzene moietyorganic nitroso compoundaryl alkyl ketonebenzoylbutyrophenonearomatic homomonocyclic compoundorganic n-nitroso compoundorganic oxidephenylbutylamineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundalkyl-phenylketone |
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