| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:01 UTC |
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| Update Date | 2025-03-21 18:33:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00095636 |
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| Frequency | 29.0 |
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| Structure | |
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| Chemical Formula | C9H12N2O |
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| Molecular Mass | 164.095 |
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| SMILES | CN(C)CC(=O)c1cccnc1 |
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| InChI Key | ZAPXFUSECVGNNM-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 | aryl alkyl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha-amino ketonesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganooxygen compoundsorganopnictogen compoundstrialkylamines |
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| Substituents | aryl alkyl ketonearomatic heteromonocyclic compoundazacycleheteroaromatic compoundtertiary aliphatic aminemethylpyridineorganic oxidepyridinealpha-aminoketoneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganoheterocyclic compound |
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