| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:12 UTC |
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| Update Date | 2025-03-21 18:36:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00110817 |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C9H16N2O2 |
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| Molecular Mass | 184.1212 |
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| SMILES | CCCCC=CC(=O)C(N)C(N)=O |
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| InChI Key | OSSWWZIHBUBNQC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compoundsacryloyl compoundscarboxylic acids and derivativesenonesfatty amideshydrocarbon derivativesketonesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidefatty acylaliphatic acyclic compoundcarbonyl groupfatty amidealpha,beta-unsaturated ketonecarboxamide groupketoneorganic oxideorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeacryloyl-groupprimary aliphatic amineorganic nitrogen compound1,3-dicarbonyl compoundorganooxygen compoundenone |
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