| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:19:41 UTC |
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| Update Date | 2025-03-21 22:15:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00531813 |
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| Frequency | 3.2 |
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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 | CN1CC2COC(=O)C21 |
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| InChI Key | CIAXABAUYZGJFN-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 heteropolycyclic compounds |
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| Alternative Parents | 1,4-oxazepinesalpha amino acidsazacyclic compoundsazetidinescarbonyl compoundscarboxylic acid estersgamma butyrolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundstetrahydrofuranstrialkylamines |
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| Substituents | carbonyl grouplactonealiphatic heteropolycyclic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundtertiary amineorganoheterocyclic compoundalpha-amino acid esterazacycletetrahydrofurantertiary aliphatic aminegamma butyrolactonepara-oxazepineazetidineoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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