| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:03:39 UTC |
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| Update Date | 2025-03-24 21:27:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01785851 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C6H9NO2 |
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| Molecular Mass | 127.0633 |
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| SMILES | CC=C(C(C)=O)C(N)=O |
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| InChI Key | PPJAIOTXFIQQOM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty amides |
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| Direct Parent | fatty amides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalpha-branched alpha,beta-unsaturated ketonescarboxylic acids and derivativesenoneshydrocarbon derivativesketonesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidealpha-branched alpha,beta-unsaturated-ketonealiphatic acyclic compoundcarbonyl groupfatty amidealpha,beta-unsaturated ketonecarboxamide groupcarboxylic acid derivativeketoneorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeacryloyl-grouporganic nitrogen compoundorganooxygen compoundenone |
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