Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 13:29:05 UTC |
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Update Date | 2025-03-24 22:05:37 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID01988552 |
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Frequency | 0.6 |
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Structure | |
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Chemical Formula | C5H8N2O2 |
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Molecular Mass | 128.0586 |
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SMILES | COC(=O)C1CCN=N1 |
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InChI Key | NPXFBJIDOATJDZ-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 acid esters |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | alpha amino acidsazacyclic compoundsazo compoundscarbonyl compoundshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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Substituents | carbonyl groupalpha-amino acid esterazacycleorganic 1,3-dipolar compoundazo compoundpropargyl-type 1,3-dipolar organic compoundorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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