| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:05 UTC |
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| Update Date | 2025-03-25 00:47:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164942 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H15NO |
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| Molecular Mass | 141.1154 |
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| SMILES | CC=C(CC)C(=O)CNC |
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| InChI Key | KVRHRCZTRYFMEZ-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 | alpha-branched alpha,beta-unsaturated ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsdialkylaminesenoneshydrocarbon derivativesketonesorganic oxidesorganopnictogen compounds |
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| Substituents | alpha-branched alpha,beta-unsaturated-ketonealiphatic acyclic compoundsecondary aliphatic aminesecondary amineketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-grouporganic nitrogen compoundamineenone |
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