| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:44:10 UTC |
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| Update Date | 2025-03-25 01:09:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02302211 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C4H7NO2 |
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| Molecular Mass | 101.0477 |
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| SMILES | COC(=O)C1CN1 |
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| InChI Key | ZWCVDRJTYFIPIV-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 compoundsaziridinecarboxylic acidsaziridinescarbonyl compoundsdialkylamineshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | carbonyl grouporganic oxidemethyl esteraliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic aminealpha-amino acid esterazacyclesecondary amineaziridinecarboxylic acidmonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundaziridineorganooxygen compoundamine |
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