| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:14:40 UTC |
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| Update Date | 2025-03-24 19:58:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01092889 |
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| Frequency | 1.3 |
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| Structure | |
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| Chemical Formula | C6H9NO2 |
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| Molecular Mass | 127.0633 |
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| SMILES | COC(=O)C1CC=CN1 |
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| InChI Key | KGOWJPZCBPFCEL-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 compoundsdialkylamineshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspyrrolines |
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| Substituents | secondary aliphatic aminecarbonyl groupalpha-amino acid esterazacyclesecondary amineorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundpyrrolinecarboxylic acid esteraliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundamine |
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