| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:02:52 UTC |
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| Update Date | 2025-03-21 20:11:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00349744 |
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| Frequency | 5.4 |
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| Structure | |
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| Chemical Formula | C5H7NO2 |
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| Molecular Mass | 113.0477 |
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| SMILES | CC(=O)C=CC(N)=O |
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| InChI Key | NVNADPKWPBIGCS-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 | carboxylic acids and derivativesenoneshydrocarbon derivativesketonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidealiphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketonecarboxamide groupcarboxylic acid derivativeketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-grouporganic nitrogen compoundenone |
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