| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:27 UTC |
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| Update Date | 2025-03-25 00:52:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193137 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H19NO2 |
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| Molecular Mass | 209.1416 |
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| SMILES | CCCC=CC=CC(=O)CCNC(C)=O |
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| InChI Key | BBZFNFLNFCBIKJ-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 | acryloyl compounds |
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| Direct Parent | acryloyl compounds |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acetamidescarboxylic acids and derivativesenoneshydrocarbon derivativesketonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketonecarboxamide groupcarboxylic acid derivativeketonesecondary carboxylic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-grouporganic nitrogen compoundacetamideenone |
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