| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:41:42 UTC |
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| Update Date | 2025-03-21 22:54:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00584433 |
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| Frequency | 2.8 |
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| Structure | |
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| Chemical Formula | C5H9NO2 |
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| Molecular Mass | 115.0633 |
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| SMILES | C=COC(=O)C(C)N |
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| InChI Key | CGEZKNASTXJNKC-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 acyclic compounds |
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| Alternative Parents | alanine and derivativesalpha amino acidscarbonyl compoundsenol estershydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupalpha-amino acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundalpha-amino acidorganopnictogen compoundalanine or derivativeshydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundenol esterorganooxygen compound |
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