Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 06:50:55 UTC |
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Update Date | 2025-03-24 17:59:43 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01036439 |
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Frequency | 1.3 |
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Structure | |
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Chemical Formula | C4H7NO2 |
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Molecular Mass | 101.0477 |
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SMILES | NCC(=O)C=CO |
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InChI Key | LLFVJIIGMDRKQW-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 | enoneshydrocarbon derivativesketonesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsvinylogous acids |
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Substituents | aliphatic acyclic compoundcarbonyl groupalpha,beta-unsaturated ketoneketonevinylogous acidorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-groupprimary aliphatic amineorganic nitrogen compoundenone |
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