| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:08:11 UTC |
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| Update Date | 2025-03-24 21:56:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01938855 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C7H11NO2 |
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| Molecular Mass | 141.079 |
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| SMILES | COC(=O)C1C=CCN1C |
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| InChI Key | XYRYIKBXSRDEBU-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 compoundscarbonyl compoundshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspyrroline 2-carboxylic acidstrialkylamines |
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| Substituents | carbonyl grouporganic oxidemethyl esteraliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundtertiary amineorganoheterocyclic compoundalpha-amino acid esterazacyclepyrroline carboxylic acid or derivativestertiary aliphatic aminepyrroline 2-carboxylic acidmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolinepyrroline carboxylic acidcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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