| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:16:50 UTC |
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| Update Date | 2025-03-24 14:15:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00810715 |
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| Frequency | 1.8 |
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| Structure | |
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| Chemical Formula | C5H8N2O3 |
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| Molecular Mass | 144.0535 |
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| SMILES | NC1CCC(=O)ONC1=O |
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| InChI Key | VCNDXCDRYHLPGA-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 heteromonocyclic compounds |
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| Alternative Parents | 1,2-oxazepinesazacyclic compoundscarbonyl compoundscarboxylic acid saltshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | ortho-oxazepinecarbonyl groupazacycleoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganic saltcarboxylic acid saltorganoheterocyclic compoundorganooxygen compound |
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